data_2kej_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 2kej _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 ' 3' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo . . . . . 0 N--CA 1.455 -0.794 0 N-CA-C 110.2 -0.731 . . . . 3.0 110.2 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.54 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 1.28 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.445 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 1.67 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 2.35 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.67 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 1.28 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 1.32 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.4 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 2.19 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.482 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 1.21 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.37 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 1.38 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.33 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.437 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 2.05 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 2.09 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 1.32 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 24' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.99 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.08 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 3.11 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 2.18 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.96 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.61 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.81 110.148 -179.231 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 26' ' ' GLN . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.6 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 2.06 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.56 110.023 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.59 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.58 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.67 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 2.24 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 1.35 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.91 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.92 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 2.11 112.084 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.87 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 1.39 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 1.34 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 2.06 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 1.5 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 1.51 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.36 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.98 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 2.28 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 1.03 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.574 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.34 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.453 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 5.46 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.517 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 1.18 111.112 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.574 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.65 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.456 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.78 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 1.44 111.575 -179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.46 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.66 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 5.25 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.523 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 6.2 mp0 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.34 110.239 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo . . . . . 0 CA--C 1.529 0.271 0 CA-C-O 120.903 0.293 . . . . 2.49 112.116 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 2.01 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' B' ' 8' ' ' ASP . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 1.41 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 2.13 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.94 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' B' ' 47' ' ' TYR . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.66 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 1.4 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.89 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.407 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 2.26 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 1.29 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 1.22 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.14 110.594 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.56 111.03 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.9 111.343 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 1.33 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.541 HG11 ' N ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.77 111.466 -179.771 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.541 ' N ' HG11 ' B' ' 20' ' ' VAL . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.25 109.982 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 2.4 110.573 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.433 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.97 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.487 HG12 ' N ' ' B' ' 25' ' ' ASN . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.64 110.22 179.149 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.487 ' N ' HG12 ' B' ' 24' ' ' VAL . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.85 110.758 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.82 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.55 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.37 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 2.38 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.92 111.857 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.9 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.677 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.74 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.67 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.45 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.95 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.94 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 2.03 113.948 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.07 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 1.57 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.407 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 1.13 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.91 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.46 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 1.36 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.93 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.405 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.91 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 2.22 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.32 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.452 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.85 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.83 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 1.26 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.57 111.143 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.03 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.409 ' N ' ' HG2' ' B' ' 55' ' ' GLN . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.79 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 1.3 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.09 113.382 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.458 -0.574 0 N-CA-C 113.772 0.643 . . . . 3.0 113.772 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.54 109.766 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 1.28 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.584 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 1.67 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 2.35 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.67 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 1.28 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 1.32 111.164 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.4 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 2.19 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 1.21 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.37 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 1.38 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.33 109.876 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.584 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 2.05 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 2.09 111.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 1.32 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.485 HG23 ' HB2' ' A' ' 6' ' ' LEU . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.99 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.08 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.465 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 3.11 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.409 ' HB ' HG21 ' A' ' 38' ' ' VAL . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 2.18 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.463 HG21 ' O ' ' A' ' 20' ' ' VAL . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.96 109.329 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.61 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.81 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.6 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 2.06 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.431 ' O ' HG23 ' A' ' 30' ' ' VAL . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.56 111.029 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 29' ' ' HIS . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.59 112.795 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.58 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.67 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 2.24 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 1.35 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.91 109.601 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.92 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' HB ' ' A' ' 23' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 2.11 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.87 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 1.39 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 1.34 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 2.06 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 1.5 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 1.51 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.36 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.98 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 2.28 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 1.03 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.447 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.34 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 5.46 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.447 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 1.18 113.039 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.65 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.78 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 1.44 112.412 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.46 113.241 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.66 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 5.25 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.34 109.885 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.464 -0.257 0 CA-C-O 121.247 0.436 . . . . 2.49 112.236 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.428 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 2.01 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.595 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 1.41 111.585 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 1.26 107.116 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.595 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 2.13 110.579 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.94 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.66 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 1.4 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.89 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 2.26 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 1.29 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 1.22 109.304 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.14 109.746 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.56 111.804 -178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.9 110.649 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 1.33 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.77 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.25 110.251 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 2.4 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.429 HG21 HG12 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.97 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.64 112.635 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.85 110.821 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' B' ' 25' ' ' ASN . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.82 109.453 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.55 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.541 ' H ' HG21 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.37 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 46.6 m80 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 2.38 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.541 HG21 ' H ' ' B' ' 28' ' ' SER . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.92 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.439 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.9 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.542 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.74 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.67 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.439 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.45 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.95 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.94 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 2.03 113.24 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.07 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 1.57 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 1.13 111.315 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.91 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.46 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 1.36 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.93 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.476 ' HB2' HG23 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.91 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 2.22 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . 0.428 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.32 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.85 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.83 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 1.26 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.57 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.03 111.483 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.483 HD12 ' O ' ' B' ' 52' ' ' CYS . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.79 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 1.3 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.09 112.236 174.692 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.446 -1.266 0 N-CA-C 110.461 -0.631 . . . . 3.0 110.461 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.54 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 1.67 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 2.35 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.67 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 1.28 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 1.32 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.4 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 2.19 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 1.21 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.37 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 1.38 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.33 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.452 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 2.05 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 2.09 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 1.32 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.99 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.418 ' O ' HG22 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.08 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 3.11 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 2.18 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.96 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.61 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.81 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.6 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 2.06 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.56 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.59 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.58 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.67 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 2.24 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.433 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 1.35 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.91 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.92 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 2.11 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.87 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 1.39 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 1.34 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 2.06 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 1.5 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 1.51 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.36 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.98 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 2.28 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 1.03 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.533 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.34 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.459 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 5.46 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 1.18 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.65 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.461 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.78 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 1.44 111.117 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.46 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.66 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 5.25 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.461 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.34 111.012 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo . . . . . 0 N--CA 1.445 -1.337 0 CA-C-O 121.186 0.411 . . . . 2.49 111.696 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.496 ' CG2' ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 2.01 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.444 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 1.41 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 1.26 107.827 178.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.444 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 2.13 109.438 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.94 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.66 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 1.4 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.89 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 2.26 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . 0.519 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 1.29 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 1.22 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.14 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.56 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.9 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 1.33 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.77 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.25 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 2.4 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.97 109.873 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.64 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.49 HD22 ' HB1' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.85 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.82 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.49 ' HB1' HD22 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.55 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.37 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 2.38 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.92 108.967 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.421 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.9 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.74 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.67 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.45 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.95 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.519 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.94 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 2.03 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.07 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 1.57 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 1.13 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.91 111.109 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.46 111.588 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 1.36 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.93 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.496 ' HA ' ' CG2' ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.91 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 2.22 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.32 109.849 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.85 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.83 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 1.26 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.57 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.03 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' B' ' 58' ' ' GLY . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.79 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 1.3 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.09 112.964 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo . . . . . 0 N--CA 1.455 -0.778 0 N-CA-C 109.699 -0.923 . . . . 3.0 109.699 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.54 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 1.28 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 1.67 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 2.35 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.67 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 1.28 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 1.32 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.4 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 2.19 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 1.21 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.37 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 1.38 116.011 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.33 110.864 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 2.05 114.733 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 2.09 111.457 178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 1.32 111.542 -178.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.535 ' O ' HG21 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.99 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.465 ' HB2' HD21 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.08 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 3.11 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 20' ' ' VAL . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 2.18 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.96 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.61 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.81 109.864 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.524 ' CB ' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.6 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 2.06 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.9 m80 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.56 110.789 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.59 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.58 112.597 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.67 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 2.24 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 1.35 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.91 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.92 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 2.11 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.87 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 1.39 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 1.34 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 2.06 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 1.5 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 1.51 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.36 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.98 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.415 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 2.28 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 1.03 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.34 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.555 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 5.46 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 1.18 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.511 ' OE1' ' HA ' ' A' ' 51' ' ' ARG . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.65 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 16.4 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.78 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 1.44 112.888 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.46 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.66 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 5.25 110.125 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.34 112.185 179.467 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 CA-C-O 121.0 0.334 . . . . 2.49 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 2.01 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 1.41 110.8 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.473 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 1.26 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 2.13 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.94 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.66 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 1.4 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.89 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 2.26 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 1.29 113.236 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 1.22 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.14 110.521 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.56 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.9 111.121 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 1.33 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.77 109.639 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.25 108.29 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 2.4 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.515 HG13 ' CG1' ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.97 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.483 ' N ' HG11 ' B' ' 23' ' ' VAL . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.64 109.3 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.85 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.82 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.55 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.37 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 2.38 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.92 112.421 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.9 109.771 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.74 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.67 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.45 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.95 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.94 112.699 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.515 ' CG1' HG13 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 2.03 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.07 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 1.57 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 1.13 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.91 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.46 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 1.36 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.93 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.473 ' CE1' ' HG ' ' B' ' 6' ' ' LEU . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.91 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 2.22 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.32 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.85 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.423 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.83 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 1.26 111.046 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.57 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.03 112.171 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.79 110.061 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 1.3 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.09 113.711 178.323 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo . . . . . 0 C--O 1.234 0.295 0 CA-C-O 121.403 0.501 . . . . 3.0 112.189 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.586 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.54 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 1.28 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.511 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 1.67 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 2.35 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.507 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.67 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 1.28 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 1.32 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.4 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 2.19 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 1.21 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.37 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 1.38 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.33 110.332 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 2.05 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 2.09 110.461 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 1.32 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.99 109.488 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.469 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.08 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 3.11 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 2.18 111.365 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.469 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.96 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.61 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.81 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.6 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 2.06 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.491 ' O ' HG21 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.56 110.58 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 29' ' ' HIS . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.59 110.135 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.58 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.475 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.67 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 2.24 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.601 ' O ' HG21 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 1.35 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.91 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.523 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.92 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.601 HG21 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 2.11 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.687 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.87 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 1.39 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 1.34 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.687 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 2.06 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 1.5 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 1.51 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.36 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.586 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.98 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 2.28 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 1.03 113.278 -178.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.34 109.512 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.561 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 5.46 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.418 ' HA ' ' CD1' ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 1.18 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.65 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.78 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.405 HD22 HD11 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 1.44 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.46 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.66 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 5.25 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.34 111.267 -178.684 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.827 0.678 . . . . 2.49 113.491 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.472 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 2.01 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.502 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 1.41 111.099 -177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 1.26 108.483 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.502 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 2.13 109.227 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.94 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.66 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 1.4 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.89 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 2.26 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 1.29 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 1.22 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.14 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.56 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.526 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 5.4 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.9 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 1.33 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.77 109.979 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.25 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 2.4 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.97 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.64 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.85 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.82 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.55 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.37 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 2.38 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.92 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.9 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.74 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.67 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.45 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.617 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.95 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.94 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 2.03 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.617 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.07 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 1.57 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 1.13 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' MET . . . . . 0.446 ' HE1' ' HA ' ' B' ' 39' ' ' GLU . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.91 111.717 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.46 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 1.36 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.93 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.472 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.91 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 2.22 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.32 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.85 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.83 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 1.26 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.57 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.03 111.212 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.418 ' CD1' ' HA ' ' A' ' 53' ' ' ALA . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.79 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 1.3 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.09 113.786 178.89 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo . . . . . 0 CA--C 1.528 0.179 0 CA-C-O 121.004 0.335 . . . . 3.0 112.857 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.47 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.54 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 1.28 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.56 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 1.67 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 2.35 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.67 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 1.28 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 1.32 111.212 178.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.4 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.411 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 2.19 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 1.21 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.37 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 1.38 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.33 108.913 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 2.05 111.059 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 2.09 110.511 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 1.32 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.56 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.99 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.08 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 3.11 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 2.18 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.96 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.61 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.81 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.6 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 2.06 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.56 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.59 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.517 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.58 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.475 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.67 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 2.24 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 1.35 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.91 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.92 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 20' ' ' VAL . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 2.11 112.339 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.87 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 1.39 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 1.34 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.416 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 2.06 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 1.5 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.411 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 1.51 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.36 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.47 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.98 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 2.28 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 1.03 113.667 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.34 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 5.46 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 1.18 109.833 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.65 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.78 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 58' ' ' GLY . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 1.44 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.46 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.66 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 5.25 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.34 114.076 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo . . . . . 0 CA--C 1.536 0.623 0 CA-C-O 121.112 0.38 . . . . 2.49 112.581 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 2.01 110.974 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.436 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 1.41 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 1.26 109.439 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.436 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 2.13 110.555 178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.94 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.66 110.931 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 1.4 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.89 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.419 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 2.26 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 1.29 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 1.22 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' SER . . . . . 0.408 ' O ' HG21 ' B' ' 20' ' ' VAL . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.14 112.046 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.56 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.9 111.629 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 1.33 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.408 HG21 ' O ' ' B' ' 16' ' ' SER . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.77 110.823 177.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.25 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.667 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 2.4 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.97 110.557 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.463 HG11 ' N ' ' B' ' 25' ' ' ASN . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.64 111.222 -179.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.463 ' N ' HG11 ' B' ' 24' ' ' VAL . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.85 110.877 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.82 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.667 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.55 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.536 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.37 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 32.1 m80 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 2.38 111.846 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 31' ' ' SER . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.92 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.404 ' O ' HG11 ' B' ' 30' ' ' VAL . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.9 110.671 178.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.674 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.74 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.67 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.45 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.674 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.95 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.94 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 2.03 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.07 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 1.57 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 1.13 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.91 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.46 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.419 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 1.36 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.93 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.91 109.378 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 2.22 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.32 109.137 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.478 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.85 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.83 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 1.26 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.478 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.57 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.43 ' HG3' ' N ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.03 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.79 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 1.3 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.09 112.451 172.885 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.614 0.589 . . . . 3.0 112.859 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.53 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.54 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 1.28 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 1.67 111.591 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 2.35 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB2' HG13 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.67 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.418 ' HA ' HD11 ' A' ' 45' ' ' LEU . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 1.28 110.225 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 16' ' ' SER . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 1.32 111.752 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.4 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 2.19 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 1.21 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.37 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 1.38 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.33 109.393 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 2.05 111.075 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 2.09 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 1.32 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.482 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.99 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.08 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.402 ' HG3' ' HB1' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 3.11 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 2.18 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.96 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.61 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.81 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.402 ' HB1' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.6 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 2.06 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.56 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.59 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.58 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.67 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 2.24 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.61 ' O ' HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 1.35 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.91 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.92 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.61 HG21 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 2.11 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.87 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 1.39 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 1.34 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 2.06 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 1.5 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 9' ' ' VAL . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 1.51 111.45 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.36 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.53 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.98 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 2.28 108.608 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 1.03 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.34 109.379 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.527 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 5.46 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 1.18 110.002 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.527 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.65 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.78 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 1.44 112.135 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.46 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.66 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' GLY . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 5.25 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.549 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.34 111.853 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.543 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo . . . . . 0 N--CA 1.456 -0.7 0 CA-C-O 120.305 0.044 . . . . 2.49 112.142 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.53 HG22 ' O ' ' B' ' 3' ' ' PRO . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 2.01 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 1.41 110.091 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.453 HD21 ' CE1' ' B' ' 47' ' ' TYR . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 1.26 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 2.13 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.94 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.66 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 1.4 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.89 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 2.26 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 1.29 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 1.22 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.14 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.56 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.466 HE21 ' HG3' ' B' ' 22' ' ' ARG . 10.1 tp60 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.9 112.228 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 1.33 110.893 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.77 110.016 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.25 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.466 ' HG3' HE21 ' B' ' 18' ' ' GLN . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 2.4 110.495 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.97 109.849 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.64 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.85 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.82 110.972 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.55 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.37 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 2.38 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.92 111.351 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.412 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.9 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.74 109.442 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.67 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.45 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.95 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.94 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.429 HG21 ' N ' ' B' ' 39' ' ' GLU . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 2.03 112.599 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.07 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 1.57 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 1.13 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.91 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.46 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 1.36 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.93 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.504 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.91 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 2.22 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . 0.496 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.32 110.044 178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.613 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.85 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.83 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 1.26 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.57 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.613 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.03 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 58' ' ' GLY . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.79 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 1.3 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . 0.486 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.09 113.668 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo . . . . . 0 C--O 1.233 0.248 0 N-CA-C 113.271 0.45 . . . . 3.0 113.271 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.54 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 1.28 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.531 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 1.67 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 2.35 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.67 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 1.28 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 1.32 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.4 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 2.19 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 1.21 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.37 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 1.38 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.593 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.33 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.531 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 2.05 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 2.09 110.501 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 1.32 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' N ' ' A' ' 21' ' ' SER . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.99 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.459 ' N ' HG21 ' A' ' 20' ' ' VAL . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.08 111.995 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 3.11 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 2.18 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.96 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.61 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.81 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.6 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 2.06 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.56 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.59 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.58 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.67 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 2.24 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.512 ' O ' HG22 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 1.35 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.91 110.016 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.92 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 2.11 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.87 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 1.39 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 1.34 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 2.06 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 1.5 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 1.51 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.36 110.3 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.98 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 2.28 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 1.03 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.34 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.458 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 5.46 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.524 ' CA ' HD12 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 1.18 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.65 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.561 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.78 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.468 HD21 HD13 ' B' ' 56' ' ' LEU . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 1.44 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.46 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.66 113.245 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 5.25 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.34 114.015 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.414 ' HB3' ' HB ' ' B' ' 48' ' ' ILE . 44.9 Cg_exo . . . . . 0 N--CA 1.476 0.487 0 CA-C-O 120.889 0.287 . . . . 2.49 112.414 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.408 HG23 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 2.01 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 1.41 110.617 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 1.26 107.61 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 2.13 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.94 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.66 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 1.4 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.89 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 2.26 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 1.29 113.89 -177.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 1.22 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' SER . . . . . 0.496 ' O ' HG22 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.14 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.56 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.9 110.975 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 1.33 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.496 HG22 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.77 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.25 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 2.4 110.348 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.472 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.97 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.64 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.85 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.82 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.481 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.55 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.37 114.186 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 2.38 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.472 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.92 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.526 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.9 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.74 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.67 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.526 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.45 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.95 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.94 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.428 ' CG2' HG12 ' B' ' 23' ' ' VAL . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 2.03 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.07 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 1.57 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 1.13 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.91 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.46 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 1.36 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.93 112.233 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.408 ' HA ' HG23 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.91 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.414 ' HB ' ' HB3' ' B' ' 3' ' ' PRO . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 2.22 108.332 179.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . 0.415 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.32 108.907 179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.85 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.83 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 1.26 109.969 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.57 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.03 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.524 HD12 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.79 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 1.3 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.09 109.099 -176.623 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.461 -0.397 0 CA-C-O 120.99 0.329 . . . . 3.0 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.406 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.54 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 1.28 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 1.67 112.311 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 2.35 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.67 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 1.28 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 1.32 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.4 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 2.19 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 1.21 112.96 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.37 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 1.38 109.956 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.33 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 20' ' ' VAL . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 2.05 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 2.09 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 1.32 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 17' ' ' TYR . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.99 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.08 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 3.11 111.233 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 2.18 109.984 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.41 HG13 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.96 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.597 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.61 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.597 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.81 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.6 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 2.06 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.56 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.59 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.58 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.67 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 2.24 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 1.35 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.91 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.92 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 2.11 111.971 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.87 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 1.39 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 1.34 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 2.06 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 1.5 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 1.51 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.36 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.98 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 2.28 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 1.03 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.34 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 5.46 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 1.18 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.65 112.441 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.78 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.467 ' CD2' HD13 ' B' ' 56' ' ' LEU . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 1.44 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.46 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.66 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 5.25 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 . . . . . 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.34 111.111 -178.638 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 121.4 0.5 . . . . 2.49 112.951 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 2.01 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.487 ' O ' HG22 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 1.41 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.584 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 1.26 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 2.13 109.548 178.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.94 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.487 HG22 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.66 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 1.4 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.89 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.548 ' CD1' ' HB1' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 2.26 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 1.29 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.487 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 1.22 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.14 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.56 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.52 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.9 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' THR . . . . . 0.442 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 1.33 111.774 -179.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.407 ' C ' ' H ' ' B' ' 22' ' ' ARG . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.77 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.499 ' O ' HG13 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.25 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 2.4 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.97 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.499 HG13 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.64 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.85 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.561 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.82 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.561 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.55 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.37 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 77.2 m80 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 2.38 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.92 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.9 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.692 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.74 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.67 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.45 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.692 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.95 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.94 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.487 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 2.03 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.07 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 1.57 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.548 ' HB1' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 1.13 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.91 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.46 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 1.36 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.93 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.584 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.91 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 2.22 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.32 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.85 110.44 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.485 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.83 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 1.26 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.57 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.03 112.262 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.79 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 1.3 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.09 113.792 179.893 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.454 -0.796 0 N-CA-C 110.666 -0.552 . . . . 3.0 110.666 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.54 109.987 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 1.28 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.591 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 1.67 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 2.35 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.67 109.735 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 1.28 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 1.32 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.4 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 2.19 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 1.21 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.37 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 1.38 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.33 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.591 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 2.05 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 2.09 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 1.32 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.99 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.08 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HD3' HG22 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 3.11 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 2.18 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.96 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.493 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.61 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.493 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.81 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.459 ' HB3' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.6 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 2.06 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.56 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.437 HG22 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.59 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.42 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.58 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.67 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 2.24 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 1.35 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.91 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.92 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.424 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 2.11 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.87 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 1.39 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 1.34 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 2.06 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.401 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 1.5 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 1.51 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.36 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.98 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 2.28 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 1.03 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.477 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.34 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.455 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 5.46 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 1.18 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.65 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.613 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.78 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 1.44 113.506 -179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.46 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.66 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 5.25 112.589 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.613 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.34 110.191 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.487 0 CA-C-O 121.2 0.417 . . . . 2.49 112.814 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.418 HG22 ' HA ' ' B' ' 47' ' ' TYR . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 2.01 109.77 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 1.41 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.436 HD23 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 1.26 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 2.13 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.94 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.66 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.57 ' HB3' ' CG2' ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 1.4 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.89 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 2.26 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . 0.424 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 1.29 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 1.22 109.506 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.14 110.671 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.56 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.9 109.456 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 1.33 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.57 ' CG2' ' HB3' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.77 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.622 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.25 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 2.4 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.586 HG13 ' N ' ' B' ' 24' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.97 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.586 ' N ' HG13 ' B' ' 23' ' ' VAL . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.64 107.32 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.622 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.85 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.82 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.55 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.37 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 2.38 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.92 114.032 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.9 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.74 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.67 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.45 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.95 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.94 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.424 ' HA ' ' CB ' ' B' ' 13' ' ' ALA . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 2.03 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.07 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 1.57 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 1.13 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.91 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.46 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 1.36 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.93 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.418 ' HA ' HG22 ' B' ' 4' ' ' VAL . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.91 112.046 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 2.22 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.32 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.597 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.85 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.83 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 1.26 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.57 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.597 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.03 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' B' ' 58' ' ' GLY . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.79 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 1.3 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.09 110.107 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 CA-C-O 121.287 0.453 . . . . 3.0 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.54 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 1.28 110.614 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 1.67 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 2.35 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.67 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 1.28 109.588 177.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 1.32 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.4 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 2.19 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 1.21 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.37 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 1.38 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.33 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 2.05 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 2.09 109.972 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 1.32 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.99 111.223 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.08 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HB3' HG22 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 3.11 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.468 ' HB ' HG13 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 2.18 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.96 109.947 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.61 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.81 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.6 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 2.06 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.409 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.56 109.216 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.59 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.58 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.67 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 2.24 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.434 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 1.35 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.91 110.843 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.92 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.468 HG13 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 2.11 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.87 111.237 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 1.39 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 1.34 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 2.06 111.11 -178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 1.5 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.406 ' HA ' HD23 ' A' ' 45' ' ' LEU . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 1.51 110.71 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.36 110.512 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.52 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.98 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 2.28 109.882 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 1.03 113.453 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.34 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 5.46 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 1.18 109.242 178.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.65 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.78 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.434 HD21 HD21 ' B' ' 56' ' ' LEU . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 1.44 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.46 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.66 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 5.25 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.34 110.212 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 C--O 1.223 -0.258 0 CA-C-O 120.57 0.154 . . . . 2.49 112.291 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 2.01 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.51 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 1.41 111.842 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 1.26 108.725 178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.51 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 2.13 109.941 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.94 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.66 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 1.4 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.89 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.414 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 2.26 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 1.29 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 1.22 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' SER . . . . . 0.425 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.14 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.56 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.9 111.299 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 1.33 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.77 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.25 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 2.4 110.279 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.452 HG21 HG22 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.97 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.64 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.85 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.82 111.241 -179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.55 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.37 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 2.38 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.92 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.9 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.74 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.67 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.95 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.558 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.94 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.452 HG22 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 2.03 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.558 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.07 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 1.57 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 1.13 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.91 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.46 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 1.36 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.93 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.91 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 2.22 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.545 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.32 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.85 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.83 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 1.26 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.57 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.03 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.434 HD21 HD21 ' A' ' 56' ' ' LEU . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.79 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 1.3 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.09 111.539 -178.701 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 C--O 1.235 0.33 0 N-CA-C 111.176 -0.355 . . . . 3.0 111.176 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.409 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.54 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 1.28 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.505 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 1.67 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 2.35 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.67 109.385 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 1.28 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 1.32 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.4 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 2.19 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 1.21 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.37 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 1.38 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.33 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.505 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 2.05 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 2.09 110.254 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 1.32 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.495 ' O ' HG21 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.99 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.08 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 3.11 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 2.18 110.527 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.96 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.61 109.874 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.81 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.6 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 2.06 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.56 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.59 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.58 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.67 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 2.24 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 1.35 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.91 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.92 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 2.11 110.899 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.87 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 1.39 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 1.34 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 2.06 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 1.5 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' HG13 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 1.51 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.36 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.98 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 2.28 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 1.03 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.57 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.34 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 5.46 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.404 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 1.18 110.096 178.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.65 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.78 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 1.44 112.076 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.46 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.66 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 54' ' ' GLN . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 5.25 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.34 111.918 -178.787 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 N--CA 1.454 -0.811 0 N-CA-C 111.175 -0.356 . . . . 2.49 111.175 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 2.01 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.631 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 1.41 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 1.26 109.92 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 2.13 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.94 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.66 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 1.4 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.89 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 2.26 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 1.29 112.429 -178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 1.22 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' SER . . . . . 0.417 ' HB2' ' OG1' ' B' ' 19' ' ' THR . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.14 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.56 112.8 -178.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.433 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.9 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' THR . . . . . 0.417 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 1.33 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.77 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.25 110.66 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.541 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 2.4 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.97 110.537 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.524 HG11 ' N ' ' B' ' 25' ' ' ASN . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.64 112.682 -178.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.524 ' N ' HG11 ' B' ' 24' ' ' VAL . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.85 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.82 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.541 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.55 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.37 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 2.38 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 27' ' ' ALA . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.92 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.503 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.9 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.74 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.67 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.45 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.95 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.94 111.943 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.431 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 2.03 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.07 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 1.57 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 1.13 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.91 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.46 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 1.36 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.93 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.91 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 2.22 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.32 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.85 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.83 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 1.26 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.57 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.03 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' B' ' 58' ' ' GLY . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.79 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 1.3 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . 0.47 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.09 114.447 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo . . . . . 0 C--O 1.236 0.393 0 CA-C-O 120.834 0.264 . . . . 3.0 111.631 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.54 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 1.28 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 1.67 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.478 ' CE2' HD12 ' A' ' 6' ' ' LEU . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 2.35 110.368 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.67 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 1.28 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 1.32 112.015 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.4 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 2.19 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 1.21 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.37 111.558 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 1.38 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.33 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 2.05 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 2.09 112.286 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 1.32 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.99 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.08 113.376 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 3.11 111.727 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 2.18 110.55 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.96 110.805 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.61 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.81 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.6 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 2.06 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.42 ' O ' HG22 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.56 108.264 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 29' ' ' HIS . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.59 111.865 -177.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.58 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.67 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 2.24 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 1.35 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.91 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.92 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 34' ' ' THR . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 2.11 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.87 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 1.39 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 1.34 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 2.06 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 1.5 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 1.51 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.36 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.556 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.98 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 2.28 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 1.03 111.804 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.34 110.169 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 5.46 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 1.18 110.694 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.65 112.742 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.78 110.25 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.508 HD23 HD12 ' B' ' 56' ' ' LEU . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 1.44 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.46 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.66 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 5.25 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.34 113.339 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.68 ' O ' HG21 ' B' ' 4' ' ' VAL . 87.4 Cg_endo . . . . . 0 N--CA 1.463 -0.286 0 N-CA-C 112.325 0.086 . . . . 2.49 112.325 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . 0.68 HG21 ' O ' ' B' ' 3' ' ' PRO . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 2.01 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 1.41 110.005 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.577 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 1.26 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 2.13 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.94 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.45 HG13 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.66 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 1.4 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.89 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 2.26 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . 0.444 ' HB3' HG22 ' B' ' 15' ' ' VAL . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 1.29 112.337 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.444 HG22 ' HB3' ' B' ' 13' ' ' ALA . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 1.22 109.991 -179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.14 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.456 ' O ' HG11 ' B' ' 20' ' ' VAL . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.56 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.9 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 1.33 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.77 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.25 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 2.4 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.97 109.538 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.64 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.85 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.82 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.55 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.37 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 2.38 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.92 109.831 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' SER . . . . . 0.507 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.9 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.551 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.67 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.507 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.45 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.95 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.94 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 2.03 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.07 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 1.57 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 1.13 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.91 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.46 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 1.36 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.93 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.577 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.91 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 2.22 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.32 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.643 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.85 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.83 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 1.26 109.916 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.643 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.57 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.03 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.79 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 1.3 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . 0.417 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.09 113.787 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 C--O 1.234 0.323 0 N-CA-C 111.18 -0.354 . . . . 3.0 111.18 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.54 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.439 ' O ' HG22 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 1.28 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.478 HD11 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 1.67 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 2.35 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.67 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 1.28 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 1.32 111.149 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.4 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 2.19 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 1.21 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.37 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 1.38 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.33 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.478 ' O ' HD11 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 2.05 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 2.09 110.478 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 1.32 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.99 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.08 111.364 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 3.11 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 2.18 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.49 HG12 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.96 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.554 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.61 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.81 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.6 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 2.06 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.56 112.343 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.59 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.58 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.67 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 2.24 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 1.35 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.91 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.92 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 2.11 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.87 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 1.39 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 1.34 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.581 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 2.06 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 1.5 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 1.51 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.36 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.98 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.428 ' O ' HG13 ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 2.28 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 1.03 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.506 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.34 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 5.46 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.421 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 1.18 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.65 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.78 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 1.44 111.827 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.46 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.66 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 5.25 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.34 111.304 178.819 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.457 -0.655 0 CA-C-O 121.446 0.519 . . . . 2.49 111.938 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 2.01 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.471 ' O ' HG22 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 1.41 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 1.26 110.155 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 2.13 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.94 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.471 HG22 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.66 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 1.4 112.077 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.89 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 2.26 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 1.29 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 1.22 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.14 112.6 -178.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.56 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.9 111.509 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 1.33 111.856 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.77 111.255 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.25 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 2.4 111.156 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.97 108.309 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' B' ' 26' ' ' GLN . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.64 110.436 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.85 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.409 ' H ' ' C ' ' B' ' 24' ' ' VAL . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.82 113.139 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.55 112.187 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.37 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 2.38 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.92 109.696 175.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.9 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.405 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.74 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.67 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.45 112.661 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.95 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.94 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 2.03 110.685 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.07 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 1.57 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 1.13 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.91 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.46 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 1.36 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.93 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.91 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 2.22 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.32 109.162 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.482 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.85 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.544 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.83 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 1.26 111.569 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.57 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.482 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.03 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.79 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 1.3 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.09 111.381 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 CA-C-O 121.192 0.414 . . . . 3.0 111.667 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.54 108.983 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 1.28 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.518 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 1.67 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 2.35 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.67 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.416 HG12 ' HB1' ' A' ' 41' ' ' ALA . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 1.28 110.504 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 16' ' ' SER . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 1.32 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.4 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 2.19 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 1.21 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.37 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 1.38 110.02 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.558 ' O ' ' HB2' ' A' ' 10' ' ' ALA . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.33 110.895 178.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 2.05 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.506 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 8.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 2.09 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 HG22 ' A' ' 34' ' ' THR . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 1.32 110.381 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.656 ' O ' HG21 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.99 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.506 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 3.11 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.656 HG21 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 2.18 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.96 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.61 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.81 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.6 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 2.06 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.56 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.59 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.58 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.67 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 2.24 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.418 HG22 HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 1.35 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.569 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.91 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.92 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 2.11 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.569 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.87 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 1.39 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 37' ' ' LYS . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 1.34 111.851 179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 2.06 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 1.5 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 1.51 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.36 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.98 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 2.28 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.62 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 1.03 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.34 109.464 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.62 ' HD2' ' O ' ' A' ' 49' ' ' PRO . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 5.46 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 1.18 112.566 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.65 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.78 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 1.44 111.129 179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.46 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.66 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 5.25 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.34 111.234 -179.649 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.485 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo . . . . . 0 N--CA 1.45 -1.082 0 CA-C-O 120.745 0.227 . . . . 2.49 111.538 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 2.01 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 1.41 110.572 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 1.26 109.035 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 2.13 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.94 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.66 110.652 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 1.4 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.89 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 2.26 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 1.29 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 1.22 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.14 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.56 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.9 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 1.33 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.77 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.619 ' O ' HG13 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.25 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.441 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 2.4 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.46 HG13 ' HB2' ' B' ' 35' ' ' ARG . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.97 110.755 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.619 HG13 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.64 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.441 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.85 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.511 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.82 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.511 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.55 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.439 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.37 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . 0.411 ' HB2' ' O ' ' B' ' 28' ' ' SER . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 2.38 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.92 110.968 177.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.9 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.74 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.67 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.45 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.95 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.94 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 2.03 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.07 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 1.57 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 1.13 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.91 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.46 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 1.36 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.93 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.91 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.485 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 2.22 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.32 108.029 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.425 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.85 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.419 ' O ' HD13 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.83 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 1.26 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.57 111.949 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.415 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.03 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.79 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 1.3 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.09 113.997 -177.602 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 111.248 -0.328 . . . . 3.0 111.248 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.54 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 1.28 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.59 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 1.67 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 2.35 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.67 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 1.28 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' A' ' 6' ' ' LEU . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 1.32 111.71 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.4 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 2.19 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 1.21 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.37 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 1.38 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.33 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.59 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 2.05 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 5.6 tp-100 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 2.09 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 1.32 112.142 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.99 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.08 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 3.11 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 2.18 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.96 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.61 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.81 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.6 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 2.06 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.56 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.59 111.029 -178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.58 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.67 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 2.24 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 1.35 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.425 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.91 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.92 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 34' ' ' THR . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 2.11 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.87 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 1.39 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 1.34 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.432 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 2.06 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 1.5 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.445 ' O ' HG23 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 1.51 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.36 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.98 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 2.28 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 1.03 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.34 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 5.46 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.474 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 1.18 111.132 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.471 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.65 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.62 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 27.9 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.78 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 1.44 111.762 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.46 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.66 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 5.25 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.34 111.548 179.777 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 N--CA 1.451 -0.98 0 CA-C-O 121.283 0.451 . . . . 2.49 112.732 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 2.01 108.609 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.503 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 1.41 111.593 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 1.26 108.366 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.503 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 2.13 109.501 177.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.94 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.409 HG21 ' O ' ' B' ' 5' ' ' THR . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.66 109.956 178.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 1.4 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.89 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 2.26 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 1.29 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 1.22 109.648 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.14 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.56 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.9 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' THR . . . . . 0.408 HG21 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 1.33 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.562 ' O ' HG11 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.77 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.25 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.412 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 2.4 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.562 HG11 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.97 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.64 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.412 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.85 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.82 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.55 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.37 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 45.4 m80 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 2.38 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.92 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.9 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.74 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.67 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.45 110.367 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.95 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.94 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 2.03 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.07 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 1.57 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 1.13 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.91 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.46 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 1.36 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.93 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.91 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 2.22 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.698 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.32 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.85 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.502 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.83 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 1.26 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.698 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.57 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.03 111.676 -178.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.405 HD13 ' O ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.79 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 1.3 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.09 113.469 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 C--O 1.239 0.533 0 CA-C-O 121.206 0.419 . . . . 3.0 111.934 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.54 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 1.28 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.427 HD23 ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 1.67 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 2.35 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.67 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 1.28 109.13 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 1.32 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.4 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 2.19 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 1.21 111.945 -178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.37 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 1.38 110.047 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.33 110.499 178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.427 ' HB2' HD23 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 2.05 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 2.09 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.438 ' O ' HG21 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 1.32 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.99 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.08 110.593 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 3.11 110.328 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.438 HG21 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 2.18 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.96 111.044 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.61 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 26' ' ' GLN . 2.2 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.81 112.647 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.6 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 2.06 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.424 ' O ' HG21 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.56 110.044 179.088 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 29' ' ' HIS . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.59 109.813 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.511 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.58 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.67 112.162 -178.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 2.24 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 1.35 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 35' ' ' ARG . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.91 110.757 179.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.92 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 2.11 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.87 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 1.39 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 1.34 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 2.06 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 1.5 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 1.51 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.36 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.98 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 2.28 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 1.03 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.447 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.34 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 5.46 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.447 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.541 ' CA ' HD13 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 1.18 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.65 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.497 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.78 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 1.44 109.487 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.46 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.66 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 5.25 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.34 108.701 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.441 -1.596 0 N-CA-C 113.032 0.359 . . . . 2.49 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 2.01 109.209 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.401 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 1.41 111.399 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 1.26 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 2.13 108.546 177.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.94 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.66 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 1.4 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.89 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.418 ' HB2' HD13 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 2.26 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 1.29 111.433 -178.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 1.22 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.14 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.56 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.9 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 1.33 111.072 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.77 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.25 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 2.4 111.802 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.97 109.32 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.64 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.85 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.82 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.55 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.37 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.0 m80 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 2.38 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.92 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.9 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.74 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.67 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.45 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.95 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.94 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.449 HG23 ' N ' ' B' ' 39' ' ' GLU . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 2.03 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.449 ' N ' HG23 ' B' ' 38' ' ' VAL . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.07 110.202 -179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 1.57 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 1.13 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' MET . . . . . 0.452 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.91 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . 0.452 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.46 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 1.36 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.93 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.91 110.65 178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 2.22 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.32 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.85 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.554 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.83 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 1.26 110.711 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.57 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.03 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.541 HD13 ' CA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.79 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 1.3 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.09 114.379 179.749 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 CA-C-O 121.015 0.34 . . . . 3.0 112.073 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.54 108.632 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' HG21 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 1.28 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.454 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 1.67 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 2.35 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.67 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 1.28 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 1.32 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.4 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 2.19 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.37 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 1.38 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.33 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.454 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 2.05 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 2.09 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 1.32 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.651 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.99 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.455 ' H ' HG21 ' A' ' 20' ' ' VAL . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.08 113.321 -178.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 3.11 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 2.18 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.96 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.61 113.037 -178.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HB2' ' H ' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.81 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.471 ' H ' ' HB2' ' A' ' 26' ' ' GLN . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.6 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 2.06 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.56 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.442 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.59 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.58 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.67 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 2.24 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 1.35 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.91 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.92 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 2.11 112.175 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.87 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 1.34 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.6 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 2.06 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 1.5 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 1.51 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.36 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.98 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 2.28 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 1.03 111.905 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.34 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.554 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 5.46 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 1.18 112.257 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.554 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.65 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.78 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.62 ' HA ' ' OE1' ' A' ' 60' ' ' GLN . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 1.44 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.46 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.66 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 5.25 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.34 112.893 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.448 -1.152 0 CA-C-O 120.962 0.318 . . . . 2.49 112.154 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 2.01 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 1.41 111.699 -177.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 1.26 108.695 177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 2.13 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.94 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.425 HG12 ' HB2' ' B' ' 41' ' ' ALA . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.66 110.632 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . 0.419 ' HA ' HG22 ' B' ' 20' ' ' VAL . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 1.4 111.625 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.89 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 2.26 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 1.29 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.403 HG21 HG21 ' B' ' 20' ' ' VAL . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 1.22 110.331 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.14 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.56 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.5 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.9 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 1.33 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' B' ' 10' ' ' ALA . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.77 111.179 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.25 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 2.4 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . 0.452 HG21 ' CG1' ' B' ' 30' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.97 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.64 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.85 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.82 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.55 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.37 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 2.38 109.744 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.452 ' CG1' HG21 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.92 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.9 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . 0.667 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.74 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . 0.489 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.67 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.45 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.667 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.95 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.489 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.94 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 2.03 112.14 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.07 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 1.57 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.425 ' HB2' HG12 ' B' ' 9' ' ' VAL . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 1.13 110.476 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' MET . . . . . 0.441 ' HE2' ' HA ' ' B' ' 39' ' ' GLU . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.91 110.554 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.46 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 1.36 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.93 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.91 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 2.22 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.32 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.85 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.408 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.83 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 1.26 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.57 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.03 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.419 HD12 HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.79 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 1.3 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.09 112.715 -178.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 CA--C 1.53 0.293 0 CA-C-O 121.021 0.342 . . . . 3.0 112.05 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.542 HG22 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.54 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.493 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 1.28 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 1.67 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 2.35 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.484 ' HB2' HG12 ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.67 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 1.28 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 1.32 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.4 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 2.19 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 1.21 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.37 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 1.38 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.33 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 2.05 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 2.09 110.687 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 1.32 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.99 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.414 ' N ' HG21 ' A' ' 20' ' ' VAL . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.08 111.974 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 3.11 111.023 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 2.18 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.96 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.61 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.81 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.6 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 2.06 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.56 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.59 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.58 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.67 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 2.24 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 1.35 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.592 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.91 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.92 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 2.11 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.87 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 1.39 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 1.34 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 2.06 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 1.5 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 1.51 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.36 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.98 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 2.28 109.994 178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 1.03 112.606 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.55 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.34 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.405 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 5.46 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 1.18 109.762 178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.65 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.441 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.78 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.452 HD23 HD12 ' B' ' 56' ' ' LEU . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 1.44 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.46 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.66 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 5.25 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.34 110.977 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo . . . . . 0 N--CA 1.471 0.199 0 CA-C-O 120.759 0.233 . . . . 2.49 111.688 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 2.01 111.442 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 1.41 110.236 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 1.26 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 2.13 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.94 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . 0.403 ' CG2' ' HB2' ' B' ' 47' ' ' TYR . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.66 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 1.4 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.89 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . 0.414 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 2.26 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 1.29 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 1.22 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.14 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . 0.409 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.56 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.9 111.828 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 1.33 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.409 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.77 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.25 110.619 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.515 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 2.4 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.97 110.183 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.64 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.85 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.82 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.55 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.515 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.37 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 52.5 m80 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 2.38 115.364 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.92 111.315 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.9 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.74 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.67 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.45 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.95 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.94 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 2.03 111.231 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.07 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 1.57 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 1.13 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.91 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.46 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 1.36 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.93 112.02 -178.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . 0.403 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.91 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 2.22 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.42 ' O ' ' HB3' ' B' ' 54' ' ' GLN . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.32 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.85 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.83 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 1.26 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.57 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.57 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.03 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.79 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 1.3 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.09 112.445 174.435 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo . . . . . 0 C--O 1.236 0.375 0 CA-C-O 121.169 0.404 . . . . 3.0 112.765 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.54 108.898 178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 1.28 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.442 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 1.67 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 2.35 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.67 109.98 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 1.28 110.774 179.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 1.32 110.913 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.4 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 2.19 110.165 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.568 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 1.21 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.37 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 1.38 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.33 109.753 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.421 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 2.05 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 2.09 110.182 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 1.32 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.99 110.564 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.08 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.512 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 3.11 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 2.18 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.96 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.61 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.81 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.6 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 2.06 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.56 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.59 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.58 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.67 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.24 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 1.35 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.91 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.92 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 2.11 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.477 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.87 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 1.39 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 37' ' ' LYS . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 1.34 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 2.06 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 1.5 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 1.51 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.36 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.98 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 2.28 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 1.03 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.34 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 5.46 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 1.18 109.619 178.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.45 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.65 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.78 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.438 ' C ' ' H ' ' A' ' 58' ' ' GLY . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 1.44 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.46 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.438 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.66 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 5.25 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.445 ' HG3' ' HB3' ' A' ' 55' ' ' GLN . 5.0 mt-30 . . . . . 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.34 110.448 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo . . . . . 0 N--CA 1.458 -0.566 0 CA-C-O 121.635 0.598 . . . . 2.49 113.099 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 2.01 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' THR . . . . . 0.545 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 1.41 110.394 -177.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 1.26 108.956 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' TYR . . . . . 0.545 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 2.13 109.689 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.94 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.66 111.698 -179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 1.4 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.89 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 2.26 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 1.29 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 1.22 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' SER . . . . . 0.458 ' O ' HG22 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.14 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.56 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.9 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 1.33 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.77 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.25 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 2.4 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.97 109.961 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.64 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . 0.453 ' OD1' ' HB3' ' B' ' 27' ' ' ALA . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.85 110.993 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.82 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' ALA . . . . . 0.453 ' HB3' ' OD1' ' B' ' 25' ' ' ASN . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.55 113.117 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.37 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 2.38 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.92 109.849 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.9 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.74 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.67 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.45 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.95 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.94 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 2.03 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.07 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 1.57 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 1.13 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.91 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.46 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 1.36 112.021 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 32.4 t30 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.93 110.76 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.91 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 2.22 107.421 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 54' ' ' GLN . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.32 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.85 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' CYS . . . . . 0.458 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.83 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 1.26 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.57 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.03 110.695 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.79 109.753 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 1.3 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.09 111.167 -179.841 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.63 0.252 . . . . 6.16 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 47.6 tttt -75.55 121.44 85.13 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.265 -0.425 . . . . 5.73 110.701 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 9.0 Cg_exo -69.19 102.88 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 121.843 1.695 . . . . 3.0 110.2 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.54 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 1.28 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.445 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 1.67 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 2.35 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.67 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 1.28 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 1.32 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.4 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 2.19 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.482 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 1.21 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.37 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 1.38 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.33 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.437 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 2.05 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 2.09 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 1.32 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 24' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.99 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.08 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 3.11 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 2.18 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.96 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.61 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.81 110.148 -179.231 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 26' ' ' GLN . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.6 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 2.06 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.445 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.56 110.023 -179.117 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.59 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.58 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.67 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 2.24 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 1.35 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.91 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.92 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 2.11 112.084 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.87 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 1.39 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 1.34 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 2.06 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 1.5 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 1.51 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.36 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.98 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 2.28 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 1.03 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.574 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.34 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.453 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 5.46 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.517 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 1.18 111.112 179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.574 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.65 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.456 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.78 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.429 HD21 ' N2 ' ' D' ' 12' ' ' ' DG' . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 1.44 111.575 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.46 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.66 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 5.25 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.523 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 6.2 mp0 79.76 28.56 0.31 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.34 110.239 177.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.06 91.35 6.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.472 -0.785 . . . . 4.14 110.361 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 tp . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.373 -0.822 . . . . 7.41 110.341 -179.149 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.169 -0.308 . . . . 7.3 110.169 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' B' ' 2' ' ' LYS . 24.2 mmtp -88.45 -59.43 0.26 Allowed Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 109.721 -0.474 . . . . 6.75 109.721 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.6 88.37 0.34 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.916 1.744 . . . . 2.49 112.116 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 2.01 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.402 ' O ' ' HB2' ' B' ' 8' ' ' ASP . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 1.41 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 2.13 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.94 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' B' ' 47' ' ' TYR . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.66 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 1.4 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.89 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.407 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 2.26 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 1.29 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 1.22 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.14 110.594 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.482 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.56 111.03 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.9 111.343 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 1.33 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.541 HG11 ' N ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.77 111.466 -179.771 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.541 ' N ' HG11 ' B' ' 20' ' ' VAL . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.25 109.982 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 2.4 110.573 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.433 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.97 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.487 HG12 ' N ' ' B' ' 25' ' ' ASN . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.64 110.22 179.149 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.487 ' N ' HG12 ' B' ' 24' ' ' VAL . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.85 110.758 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.82 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.55 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.37 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 2.38 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.92 111.857 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.9 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.677 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.74 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.67 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.45 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.95 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.94 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 2.03 113.948 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.07 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 1.57 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.407 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 1.13 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.91 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.46 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 1.36 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.93 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.405 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.91 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 2.22 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.32 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.452 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.85 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.83 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 1.26 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' B' ' 59' ' ' LYS . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.57 111.143 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.03 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.409 ' N ' ' HG2' ' B' ' 55' ' ' GLN . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.79 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 1.3 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.36 17.37 6.19 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.09 113.382 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' B' ' 54' ' ' GLN . 29.5 mttp -114.26 105.18 12.86 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 109.018 -0.734 . . . . 6.26 109.018 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -70.93 78.19 0.64 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.31 -0.859 . . . . 5.54 109.972 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m -98.36 -13.76 20.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.322 -0.854 . . . . 6.13 111.491 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 18.4 mt . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.572 -0.727 . . . . 8.07 109.521 179.234 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.466 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.449 -2.322 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.501 -1.437 0 C3'-C2'-C1' 99.602 -2.213 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.419 ' C6 ' ' C6 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 99.622 -2.199 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.601 ' C8 ' ' H73' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.138 0 C3'-C2'-C1' 99.292 -2.434 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.601 ' H73' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.888 0 C3'-C2'-C1' 98.856 -2.746 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.489 ' C2 ' ' C2 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.653 0 C3'-C2'-C1' 99.428 -2.337 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.556 -2.245 . . . . 1.15 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.333 -2.405 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.106 0 C3'-C2'-C1' 99.469 -2.308 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.267 0 C3'-C2'-C1' 99.73 -2.121 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.566 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.938 0 C3'-C2'-C1' 100.003 -1.926 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.566 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.86 0 C3'-C2'-C1' 98.554 -2.962 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.022 0 C3'-C2'-C1' 99.472 -2.306 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C3'-C2'-C1' 99.044 -2.611 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 99.546 -2.253 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 C3'-C2'-C1' 99.894 -2.004 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.821 0 C3'-C2'-C1' 99.457 -2.317 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.498 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.083 -2.584 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.498 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.25 -2.464 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.472 H2'' ' C5 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 O4'-C1'-C2' 103.891 -2.008 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.472 ' C5 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.435 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.513 -2.277 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 N19-C1'-C2' 115.831 1.019 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.691 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 C3'-C2'-C1' 100.617 -1.488 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.691 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.845 -0.611 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.62 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.337 -0.973 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.62 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 O4'-C1'-C2' 104.599 -1.364 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.554 " O5'" H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.439 -0.662 0 C3'-C2'-C1' 105.049 1.678 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.483 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 C3'-C2'-C1' 105.262 1.83 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.483 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 C3'-C2'-C1' 104.824 1.517 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.748 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 105.541 2.03 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.748 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.939 0 O4'-C1'-C2' 106.981 0.801 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.626 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C4'-C3'-O3' 113.502 1.455 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.626 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 P-O3'-C3' 120.892 0.993 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.429 ' N2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.406 -1.11 0 C1'-O4'-C4' 106.887 -2.01 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.489 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 104.966 1.619 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.281 1.081 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.615 0.655 0 C4'-C3'-C2' 104.245 1.045 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C4'-C3'-C2' 101.835 -1.365 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 100.742 -1.398 . . . . 1.57 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.489 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 C2'-C3'-O3' 112.514 0.709 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 N19-C1'-C2' 115.824 1.015 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 104.399 1.199 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.956 0 C3'-C2'-C1' 99.598 -2.216 . . . . 2.18 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 O4'-C1'-C2' 105.254 -0.769 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.509 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.2 mmm . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 110.266 -0.272 . . . . 6.16 110.266 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.403 ' HG2' ' CG2' ' A' ' 4' ' ' VAL . 28.8 tttp -102.8 100.92 17.95 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.254 -0.43 . . . . 5.73 110.0 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.509 ' HD3' ' O ' ' A' ' 1' ' ' MET . 1.2 Cg_endo -80.16 65.78 8.87 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 3.0 113.772 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.403 ' CG2' ' HG2' ' A' ' 2' ' ' LYS . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.54 109.766 178.087 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 1.28 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.584 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 1.67 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 2.35 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.67 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 1.28 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 1.32 111.164 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.4 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 2.19 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 1.21 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.37 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 1.38 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.55 ' HG ' ' P ' ' C' ' 5' ' ' ' DG' . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.33 109.876 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.584 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 2.05 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 2.09 111.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 1.32 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.485 HG23 ' HB2' ' A' ' 6' ' ' LEU . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.99 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.08 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.465 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 3.11 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.409 ' HB ' HG21 ' A' ' 38' ' ' VAL . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 2.18 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.463 HG21 ' O ' ' A' ' 20' ' ' VAL . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.96 109.329 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.61 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.81 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.6 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 2.06 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.565 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.56 111.029 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 29' ' ' HIS . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.59 112.795 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.58 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.67 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 2.24 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 1.35 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.91 109.601 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.92 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.409 HG21 ' HB ' ' A' ' 23' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 2.11 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.87 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 1.39 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 1.34 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 2.06 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 1.5 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 1.51 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.36 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.98 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 2.28 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 1.03 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.447 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.34 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.595 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 5.46 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.447 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 1.18 113.039 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.65 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.78 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 1.44 112.412 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.46 113.241 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.66 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 5.25 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.544 ' NE2' " H5'" ' C' ' 11' ' ' ' DG' . 1.0 OUTLIER -69.86 -39.35 76.42 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.34 109.885 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.91 138.52 37.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.509 -0.769 . . . . 4.14 110.187 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD22 ' SD ' ' B' ' 1' ' ' MET . 1.6 pt? . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.931 -0.577 . . . . 7.41 109.623 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.5 ' SD ' HD22 ' A' ' 62' ' ' LEU . 21.2 mmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 110.045 -0.354 . . . . 7.3 110.045 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -134.71 120.4 14.38 Favored Pre-proline 0 C--N 1.323 -0.564 0 C-N-CA 120.96 -0.296 . . . . 6.75 111.727 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.41 -168.16 0.54 Allowed 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 123.641 2.894 . . . . 2.49 112.236 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.428 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 2.01 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.605 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 1.41 111.585 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 1.26 107.116 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.595 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 2.13 110.579 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.94 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.66 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 1.4 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.89 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 2.26 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 1.29 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 1.22 109.304 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.403 ' HG ' " H2'" ' D' ' 5' ' ' ' DG' . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.14 109.746 178.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.469 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.56 111.804 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.406 ' HG3' ' H61' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.9 110.649 178.631 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 1.33 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.77 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.25 110.251 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 2.4 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.429 HG21 HG12 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.97 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.64 112.635 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.402 ' O ' ' HB3' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.85 110.821 -178.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.402 ' HB3' ' O ' ' B' ' 25' ' ' ASN . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.82 109.453 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.55 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.541 ' H ' HG21 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.37 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 46.6 m80 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 2.38 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.541 HG21 ' H ' ' B' ' 28' ' ' SER . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.92 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.439 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.9 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.542 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.74 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.67 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.439 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.45 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.95 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.94 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 2.03 113.24 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.07 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 1.57 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 1.13 111.315 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.91 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.46 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 1.36 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.93 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.476 ' HB2' HG23 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.91 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 2.22 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.428 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.32 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.85 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.483 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.83 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 1.26 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.57 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.457 ' OE1' ' HE3' ' B' ' 59' ' ' LYS . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.03 111.483 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.483 HD12 ' O ' ' B' ' 52' ' ' CYS . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.79 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 1.3 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 174.92 40.05 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.09 112.236 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.457 ' HE3' ' OE1' ' B' ' 55' ' ' GLN . 0.3 OUTLIER -119.54 97.28 5.57 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.247 0.546 . . . . 6.26 109.813 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 22.5 mp0 -90.8 100.33 13.21 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.46 -0.791 . . . . 5.54 110.005 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.35 74.46 8.35 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 112.055 0.391 . . . . 6.13 112.055 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 29.2 tp . . . . . 0 C--O 1.244 0.798 0 CA-C-N 115.084 -0.962 . . . . 8.07 111.163 179.162 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.193 0 C3'-C2'-C1' 98.728 -2.837 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.485 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 99.671 -2.164 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.556 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 99.909 -1.994 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.565 ' OP2' ' HA ' ' A' ' 29' ' ' HIS . . . . . . . . 0 P--O3' 1.621 1.152 0 C3'-C2'-C1' 99.953 -1.962 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.486 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.142 -2.541 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.55 ' P ' ' HG ' ' A' ' 16' ' ' SER . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.914 -1.99 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.49 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.016 -2.631 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.332 -2.406 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.105 -2.568 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.411 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.456 0 C3'-C2'-C1' 99.478 -2.302 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.488 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.368 0 C3'-C2'-C1' 100.116 -1.846 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.577 ' C6 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.043 0 C3'-C2'-C1' 99.785 -2.082 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.605 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.286 0 C3'-C2'-C1' 98.729 -2.837 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.477 " C2'" ' H73' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 99.907 -1.995 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.477 ' H73' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.647 -2.181 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.406 ' H61' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.719 0 O4'-C1'-C2' 103.88 -2.019 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.528 -2.265 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.445 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.099 0 C3'-C2'-C1' 99.052 -2.606 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.596 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.555 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.596 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-C2' 103.964 -1.942 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.46 -2.314 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.016 0 C3'-C2'-C1' 99.509 -2.279 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-C2' 105.142 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.51 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 100.623 -1.484 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.51 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C5'-C4'-C3' 116.161 0.974 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.696 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-C2' 104.911 -1.081 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.696 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.579 1.379 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.403 " H2'" ' HG ' ' B' ' 16' ' ' SER . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 O4'-C1'-C2' 107.246 1.042 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.547 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.107 0 C3'-C2'-C1' 105.583 2.06 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.547 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.524 0.622 0 C4'-C3'-C2' 104.896 1.696 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.669 1.469 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.505 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 O4'-C1'-C2' 105.18 -0.837 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.505 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 O4'-C1'-C2' 107.481 1.255 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.781 0 C3'-C2'-C1' 105.356 1.897 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.039 0 C4'-C3'-C2' 104.538 1.338 . . . . 1.19 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.894 0 C3'-C2'-C1' 105.242 1.815 . . . . 0.64 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.592 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.884 0 O4'-C1'-C2' 104.716 -1.258 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.592 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 101.475 -0.875 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.456 ' C8 ' ' C2 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 101.386 -0.938 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.958 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 105.106 1.719 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.958 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.619 1.0 0 P-O3'-C3' 120.67 0.808 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.53 H2'' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.928 0 C3'-C2'-C1' 100.187 -1.795 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.53 ' C6 ' H2'' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.683 1.483 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 N19-C1'-C2' 116.136 1.21 . . . . 2.18 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 100.164 -1.811 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.408 -0.219 . . . . 6.16 110.408 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -81.69 131.4 57.81 Favored Pre-proline 0 CA--C 1.514 -0.418 0 N-CA-C 109.356 -0.609 . . . . 5.73 109.356 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.91 119.16 5.9 Favored 'Trans proline' 0 N--CA 1.446 -1.266 0 C-N-CA 121.378 1.385 . . . . 3.0 110.461 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.54 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.452 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 1.67 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 2.35 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.67 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 1.28 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 1.32 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.4 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 2.19 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 1.21 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.37 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 1.38 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.33 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.452 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 2.05 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 2.09 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 1.32 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.99 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.418 ' O ' HG22 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.08 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 3.11 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 2.18 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.96 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.61 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.81 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.6 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 2.06 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.56 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.59 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.58 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.67 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 2.24 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.433 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 1.35 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.91 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.92 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 2.11 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.87 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 1.39 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 1.34 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 2.06 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 1.5 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 1.51 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.36 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.98 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 2.28 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 1.03 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.533 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.34 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.459 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 5.46 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 1.18 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.65 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.461 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.78 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 1.44 111.117 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.46 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.66 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 5.25 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.461 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 -84.6 -28.08 26.78 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.34 111.012 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.581 ' OG ' ' HG3' ' B' ' 2' ' ' LYS . 1.7 m -107.57 73.6 0.92 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.712 -0.676 . . . . 4.14 110.556 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 pt? . . . . . 0 C--O 1.245 0.826 0 CA-C-O 118.378 -0.82 . . . . 7.41 110.393 -179.925 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.938 -0.393 . . . . 7.3 109.938 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.581 ' HG3' ' OG ' ' A' ' 61' ' ' SER . 44.6 tttm -86.4 125.32 68.02 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.996 -0.282 . . . . 6.75 111.516 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -96.0 -176.97 0.37 Allowed 'Trans proline' 0 N--CA 1.445 -1.337 0 C-N-CA 122.997 2.465 . . . . 2.49 111.696 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.496 ' CG2' ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 2.01 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.49 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 1.41 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 1.26 107.827 178.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.444 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 2.13 109.438 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.94 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.66 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 1.4 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.89 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 2.26 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . 0.519 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 1.29 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 1.22 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.14 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.56 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.9 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 1.33 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.77 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.25 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 2.4 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.97 109.873 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.64 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.49 HD22 ' HB1' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.85 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.82 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.49 ' HB1' HD22 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.55 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.37 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 2.38 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.92 108.967 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.421 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.9 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.74 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.67 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.421 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.45 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.95 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.519 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.94 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 2.03 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.07 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 1.57 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 1.13 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.91 111.109 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.46 111.588 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 1.36 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.93 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.496 ' HA ' ' CG2' ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.91 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 2.22 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.32 109.849 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.85 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.83 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 1.26 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.57 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.03 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' B' ' 58' ' ' GLY . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.79 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 1.3 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 89.0 38.42 6.85 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.09 112.964 178.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.422 ' HZ3' " H4'" ' C' ' 13' ' ' ' DG' . 10.7 mtpp -100.4 3.77 43.38 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.516 -0.474 . . . . 6.26 109.748 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -103.78 101.42 11.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.437 -0.347 . . . . 5.54 110.828 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.01 74.93 8.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.719 0.295 . . . . 6.13 110.574 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 10.8 tp . . . . . 0 C--O 1.246 0.907 0 CA-C-N 115.768 -0.651 . . . . 8.07 111.103 -179.544 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.45 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.479 -2.3 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.463 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.261 0 C3'-C2'-C1' 99.683 -2.155 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.463 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 99.813 -2.062 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.441 ' C8 ' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.962 0 C3'-C2'-C1' 99.386 -2.367 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.441 ' C7 ' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 99.061 -2.599 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.407 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.876 -2.017 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.429 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.788 -2.08 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.429 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 99.498 -2.287 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 99.536 -2.26 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.127 -1.794 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.451 ' C6 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.87 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.49 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.713 -2.134 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.536 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 99.815 -2.061 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.536 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.205 -2.497 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.779 0 C3'-C2'-C1' 99.423 -2.341 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.921 0 C3'-C2'-C1' 99.561 -2.242 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.526 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 C3'-C2'-C1' 99.705 -2.139 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.526 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.272 -2.448 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.57 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.776 0 C3'-C2'-C1' 99.559 -2.244 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.57 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.721 -2.128 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.488 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.34 -2.4 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.488 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 C3'-C2'-C1' 99.589 -2.222 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 101.309 -0.993 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.651 -1.464 . . . . 2.52 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 104.532 1.309 . . . . 1.97 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.535 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C4'-C3'-C2' 104.915 1.715 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.585 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.511 1.311 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.585 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 O4'-C1'-C2' 105.395 -0.641 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.448 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 115.724 0.952 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.752 0 O4'-C1'-C2' 104.587 -1.375 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.585 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.439 1.956 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.585 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 101.411 -0.921 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.435 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.705 2.147 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.435 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 C4'-C3'-C2' 104.251 1.051 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.501 " O3'" ' HB2' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.405 -1.122 0 C3'-C2'-C1' 105.31 1.865 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.475 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.842 0 C3'-C2'-C1' 105.224 1.803 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.229 -1.765 . . . . 1.15 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.706 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.524 0.64 0 C3'-C2'-C1' 105.75 2.179 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.706 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.624 1.442 0 P-O3'-C3' 120.581 0.734 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.575 " H1'" ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C3'-C2'-C1' 100.118 -1.844 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.575 ' C8 ' " H1'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-C3' 115.601 0.6 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 N19-C1'-C2' 116.12 1.2 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.402 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 N19-C1'-C2' 116.065 1.166 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.402 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.829 -1.337 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.251 1.051 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 mmt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 109.938 -0.393 . . . . 6.16 109.938 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -77.22 122.57 86.4 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.412 -0.358 . . . . 5.73 110.608 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -59.91 130.14 33.52 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.225 1.95 . . . . 3.0 109.699 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.54 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 1.28 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 1.67 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 2.35 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.67 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 1.28 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 1.32 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.4 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 2.19 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 1.21 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.37 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 1.38 116.011 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.523 ' HG ' ' P ' ' C' ' 5' ' ' ' DG' . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.33 110.864 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 2.05 114.733 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 2.09 111.457 178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 1.32 111.542 -178.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.535 ' O ' HG21 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.99 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.465 ' HB2' HD21 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.08 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 3.11 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 20' ' ' VAL . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 2.18 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.96 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.61 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.81 109.864 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.524 ' CB ' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.6 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 2.06 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.401 ' O ' ' C7 ' ' C' ' 4' ' ' ' DT' . 1.9 m80 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.56 110.789 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.59 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.444 ' H ' " H3'" ' C' ' 3' ' ' ' DA' . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.58 112.597 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.67 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 2.24 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 1.35 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.46 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.91 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.92 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 2.11 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.87 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 1.39 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 1.34 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 2.06 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 1.5 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 1.51 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.36 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.98 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.415 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 2.28 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.415 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 1.03 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.34 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.555 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 5.46 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 1.18 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.562 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.65 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.555 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 16.4 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.78 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 1.44 112.888 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.46 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.66 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HZ3' " C5'" ' D' ' 14' ' ' ' DT' . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 5.25 110.125 -178.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -45.61 99.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.34 112.185 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.6 p -118.0 -32.56 4.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.66 -0.7 . . . . 4.14 110.06 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.511 -0.757 . . . . 7.41 109.778 179.647 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.934 0.397 . . . . 7.3 110.666 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.421 ' HE2' ' CG1' ' B' ' 4' ' ' VAL . 80.8 tttt -124.79 96.56 40.32 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.061 -0.518 . . . . 6.75 110.494 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -87.61 87.42 0.63 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.433 2.088 . . . . 2.49 112.291 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.45 HG23 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 2.01 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 1.41 110.8 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.473 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 1.26 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 2.13 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.94 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.66 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 1.4 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.89 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 2.26 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 1.29 113.236 -178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 1.22 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.14 110.521 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.56 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.9 111.121 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 1.33 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.77 109.639 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.25 108.29 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 2.4 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.515 HG13 ' CG1' ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.97 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.483 ' N ' HG11 ' B' ' 23' ' ' VAL . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.64 109.3 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.85 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.82 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.55 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.37 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 2.38 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.92 112.421 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.453 ' HG ' " C5'" ' D' ' 3' ' ' ' DT' . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.9 109.771 177.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.74 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.67 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.45 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.95 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.94 112.699 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.515 ' CG1' HG13 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 2.03 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.07 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 1.57 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 1.13 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.91 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.46 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 1.36 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.93 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.473 ' CE1' ' HG ' ' B' ' 6' ' ' LEU . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.91 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 2.22 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.32 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.85 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.423 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.83 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . 0.436 ' HB1' " H5'" ' C' ' 12' ' ' ' DA' . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 1.26 111.046 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.57 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.492 ' HB2' ' H ' ' B' ' 61' ' ' SER . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.03 112.171 -178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.79 110.061 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 1.3 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.34 -69.25 0.32 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.09 113.711 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.495 ' HZ1' " H4'" ' C' ' 13' ' ' ' DG' . 0.0 OUTLIER -106.28 91.17 3.6 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.707 0.289 . . . . 6.26 111.328 -178.148 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.445 ' HA ' ' HB2' ' B' ' 55' ' ' GLN . 4.6 mt-30 -61.26 128.96 38.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.106 -0.497 . . . . 5.54 110.901 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' SER . . . . . 0.492 ' H ' ' HB2' ' B' ' 55' ' ' GLN . 0.7 OUTLIER -78.53 -13.13 59.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 6.13 111.137 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-N 115.458 -0.792 . . . . 8.07 110.159 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.419 " H2'" HO5' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 98.974 -2.661 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.421 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.308 0 C3'-C2'-C1' 99.356 -2.389 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.423 ' C2 ' ' C4 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.444 " H3'" ' H ' ' A' ' 31' ' ' SER . . . . . . . . 0 C2'--C1' 1.506 -1.102 0 C3'-C2'-C1' 99.637 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.401 ' C7 ' ' O ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.901 0 C3'-C2'-C1' 99.03 -2.622 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.523 ' P ' ' HG ' ' A' ' 16' ' ' SER . . . . . . . . 0 P--O3' 1.597 -0.86 0 C3'-C2'-C1' 99.655 -2.175 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.424 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.771 0 C3'-C2'-C1' 99.584 -2.226 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 99.808 -2.066 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 99.274 -2.447 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.326 0 C3'-C2'-C1' 99.88 -2.014 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.44 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.895 -2.004 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.502 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.639 -2.187 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.502 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 C3'-C2'-C1' 98.668 -2.88 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.495 " H4'" ' HZ1' ' B' ' 59' ' ' LYS . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.59 -2.222 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.801 0 C3'-C2'-C1' 99.208 -2.494 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 C3'-C2'-C1' 99.646 -2.181 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 O4'-C1'-C2' 104.051 -1.863 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.502 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.502 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 99.207 -2.495 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.416 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.149 0 C3'-C2'-C1' 99.643 -2.184 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.852 -2.034 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-C2' 103.651 -2.227 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.762 -2.098 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.545 0 C3'-C2'-C1' 101.48 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.566 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.675 -2.161 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.566 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.494 0.567 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.541 " H5'" " H1'" ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.558 0 C3'-C2'-C1' 105.557 2.041 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.516 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 O4'-C1'-N19 108.267 0.584 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.408 H2'' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 C3'-C2'-C1' 105.138 1.741 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.408 ' C6 ' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 N19-C1'-C2' 116.233 1.271 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.526 0.822 0 C1'-O4'-C4' 107.403 -1.641 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.751 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.925 0 C1'-O4'-C4' 107.571 -1.52 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.751 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 115.202 0.626 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.417 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.706 0 C4'-C3'-O3' 113.866 1.621 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.417 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 C4'-C3'-C2' 104.367 1.167 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.405 -1.185 0 N19-C1'-C2' 116.537 1.46 . . . . 1.19 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.562 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C1'-O4'-C4' 106.805 -2.068 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.451 " C5'" ' HZ3' ' A' ' 59' ' ' LYS . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.988 -1.223 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.785 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.827 0 C3'-C2'-C1' 105.605 2.075 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.785 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.36 0 C3'-C2'-C1' 101.168 -1.094 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.899 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.869 0 C3'-C2'-C1' 105.457 1.969 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.899 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.63 1.903 0 P-O3'-C3' 120.639 0.783 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.5 ' C6 ' ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 O4'-C1'-C2' 104.901 -1.09 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.5 ' H71' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 106.887 0.716 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.793 0.995 . . . . 2.18 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.762 0 C3'-C2'-C1' 101.682 -0.727 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.852 -0.425 . . . . 6.16 109.852 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -70.14 128.16 91.74 Favored Pre-proline 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 5.73 110.77 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -52.26 123.78 13.44 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.816 2.344 . . . . 3.0 112.189 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.586 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.54 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 1.28 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.511 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 1.67 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 2.35 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.507 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.67 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 1.28 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 1.32 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.4 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 2.19 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 1.21 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.37 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 1.38 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.429 ' HG ' ' P ' ' C' ' 5' ' ' ' DG' . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.33 110.332 179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 2.05 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 2.09 110.461 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 1.32 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.99 109.488 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.469 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.08 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 3.11 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 2.18 111.365 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.469 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.96 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.61 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.81 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.6 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 2.06 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.491 ' O ' HG21 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.56 110.58 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 29' ' ' HIS . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.59 110.135 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.58 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.475 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.67 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 2.24 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.601 ' O ' HG21 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 1.35 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.91 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.523 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.92 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.601 HG21 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 2.11 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.687 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.87 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 1.39 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 1.34 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.687 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 2.06 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 1.5 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 1.51 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.36 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.586 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.98 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 2.28 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 1.03 113.278 -178.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.48 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.34 109.512 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.561 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 5.46 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.418 ' HA ' ' CD1' ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 1.18 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.65 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.78 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.405 HD22 HD11 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 1.44 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.46 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.66 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 5.25 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.409 HE22 " H5'" ' C' ' 11' ' ' ' DG' . 9.5 mt-30 -112.05 -107.13 0.37 Allowed 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.34 111.267 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.75 1.76 55.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 4.14 110.922 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.131 -0.938 . . . . 7.41 110.052 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.3 mmm . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 110.199 -0.297 . . . . 7.3 110.199 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -65.01 122.78 81.48 Favored Pre-proline 0 C--O 1.237 0.416 0 N-CA-C 110.305 -0.257 . . . . 6.75 110.305 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -76.25 171.58 17.83 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.738 2.292 . . . . 2.49 113.491 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.472 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 2.01 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.586 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 1.41 111.099 -177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 1.26 108.483 178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.502 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 2.13 109.227 178.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.94 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.66 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 1.4 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.89 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 2.26 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 1.29 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 1.22 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.14 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.56 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.526 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 5.4 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.9 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 1.33 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.77 109.979 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.25 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.526 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 2.4 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.97 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.64 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.85 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.82 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.55 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.37 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 2.38 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.92 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.9 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.74 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.67 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.45 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.617 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.95 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.94 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 2.03 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.617 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.07 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.594 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 1.57 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 1.13 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' MET . . . . . 0.446 ' HE1' ' HA ' ' B' ' 39' ' ' GLU . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.91 111.717 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.46 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . 0.594 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 1.36 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.93 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.472 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.91 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 2.22 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.32 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.85 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.83 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 1.26 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.57 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.753 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.03 111.212 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.418 ' CD1' ' HA ' ' A' ' 53' ' ' ALA . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.79 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 1.3 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 117.6 24.39 3.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.09 113.786 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.753 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 4.3 mttp -117.48 98.46 6.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.555 0.693 . . . . 6.26 110.228 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -138.81 124.76 19.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.98 -1.009 . . . . 5.54 110.948 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.81 -7.08 53.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.247 -0.433 . . . . 6.13 110.264 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--O 1.246 0.875 0 CA-C-N 115.129 -0.941 . . . . 8.07 110.709 -179.902 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.496 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.206 0 C3'-C2'-C1' 99.18 -2.514 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.496 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.328 0 C3'-C2'-C1' 99.395 -2.361 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.443 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.712 0 C3'-C2'-C1' 99.354 -2.39 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.645 ' C8 ' ' H73' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C3'-C2'-C1' 98.979 -2.658 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.645 ' H73' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 98.973 -2.662 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.547 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C3'-C2'-C1' 99.79 -2.078 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.547 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.727 0 C3'-C2'-C1' 99.558 -2.245 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.826 0 C3'-C2'-C1' 99.197 -2.502 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.296 0 C3'-C2'-C1' 99.64 -2.186 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 O4'-C1'-C2' 104.071 -1.845 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.537 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C3'-C2'-C1' 99.718 -2.13 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.586 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 C3'-C2'-C1' 98.976 -2.66 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.897 0 O4'-C1'-C2' 103.929 -1.973 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.502 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.015 0 C3'-C2'-C1' 99.62 -2.2 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.502 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.846 0 C3'-C2'-C1' 99.654 -2.176 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.859 0 C3'-C2'-C1' 99.877 -2.017 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.285 -2.44 . . . . 1.1 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.465 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C3'-C2'-C1' 99.772 -2.092 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.59 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 O4'-C1'-C2' 103.995 -1.914 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.59 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.905 0 C3'-C2'-C1' 99.641 -2.185 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.331 -2.406 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.87 0.836 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.479 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 99.454 -2.318 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.479 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C5'-C4'-C3' 115.805 0.736 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.503 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.26 1.06 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.503 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-C2' 104.904 -1.088 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.427 ' C8 ' ' H73' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 102.409 -0.791 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.427 ' H73' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-C2' 107.394 1.177 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.418 " H5'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 O4'-C1'-C2' 104.869 -1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.447 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 105.431 1.951 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.447 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 C3'-C2'-C1' 101.152 -1.106 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 N19-C1'-C2' 116.204 1.253 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 N19-C1'-C2' 113.493 -0.442 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.506 H2'' " O5'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.529 1.13 0 C3'-C2'-C1' 105.391 1.922 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.506 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.773 0 C3'-C2'-C1' 105.153 1.752 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.422 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-C2' 104.705 -1.268 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.422 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.614 0.544 0 O4'-C1'-C2' 107.199 0.999 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.413 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 C3'-C2'-C1' 100.443 -1.612 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.526 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 O4'-C1'-C2' 105.011 -0.99 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.526 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.05 -1.15 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 115.081 0.551 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.425 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.785 0 C4'-C3'-C2' 104.629 1.429 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.455 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.366 -1.576 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.455 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 100.165 -1.811 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 120.978 0.418 . . . . 6.16 110.978 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -90.51 134.44 30.96 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.83 -0.623 . . . . 5.73 110.294 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.96 53.38 4.41 Favored 'Trans proline' 0 CA--C 1.528 0.179 0 C-N-CA 122.924 2.416 . . . . 3.0 112.857 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.47 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.54 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.424 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 1.28 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.56 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 1.67 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 2.35 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.67 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 1.28 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 1.32 111.212 178.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.4 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.411 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 2.19 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 1.21 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.37 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 1.38 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.33 108.913 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 2.05 111.059 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 2.09 110.511 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 1.32 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.56 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.99 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.08 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 3.11 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 2.18 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.96 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.61 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.81 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.6 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 2.06 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.56 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.59 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.517 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.58 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.475 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.67 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 2.24 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 1.35 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.91 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.92 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.404 HG11 ' HA ' ' A' ' 20' ' ' VAL . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 2.11 112.339 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.87 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 1.39 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 1.34 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.416 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 2.06 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 1.5 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.411 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 1.51 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.36 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.47 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.98 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 2.28 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.662 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 1.03 113.667 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.34 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 5.46 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 1.18 109.833 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.65 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.527 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.78 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 58' ' ' GLY . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 1.44 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.46 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.66 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 5.25 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.467 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 -48.14 141.18 6.46 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.34 114.076 -178.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.9 p -105.09 -3.22 23.37 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.804 -1.089 . . . . 4.14 111.001 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.676 0 CA-C-O 118.574 -0.727 . . . . 7.41 110.004 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.8 ttt . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.357 0.598 . . . . 7.3 110.618 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -128.27 103.95 20.21 Favored Pre-proline 0 C--O 1.222 -0.354 0 CA-C-N 115.71 -0.677 . . . . 6.75 110.013 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -68.91 92.06 0.44 Allowed 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.697 2.265 . . . . 2.49 112.581 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 2.01 110.974 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.436 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 1.41 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 1.26 109.439 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.436 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 2.13 110.555 178.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.94 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.66 110.931 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 1.4 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.89 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.419 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 2.26 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 1.29 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 1.22 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.408 ' O ' HG21 ' B' ' 20' ' ' VAL . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.14 112.046 -177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.56 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.9 111.629 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 1.33 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.408 HG21 ' O ' ' B' ' 16' ' ' SER . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.77 110.823 177.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.25 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.667 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 2.4 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.97 110.557 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.463 HG11 ' N ' ' B' ' 25' ' ' ASN . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.64 111.222 -179.0 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.463 ' N ' HG11 ' B' ' 24' ' ' VAL . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.85 110.877 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.82 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.667 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.55 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.536 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.37 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 32.1 m80 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 2.38 111.846 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 31' ' ' SER . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.92 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.404 ' O ' HG11 ' B' ' 30' ' ' VAL . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.9 110.671 178.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.674 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.74 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.67 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.45 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.674 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.95 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.94 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 2.03 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.07 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 1.57 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 1.13 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.91 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.46 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.419 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 1.36 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.93 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.91 109.378 179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 2.22 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.32 109.137 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.478 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.85 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.83 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 1.26 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.478 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.57 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.43 ' HG3' ' N ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.03 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.79 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 1.3 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.42 -71.0 0.03 OUTLIER Glycine 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.09 112.451 172.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 74.16 2.95 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 112.663 0.616 . . . . 6.26 112.663 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -46.46 131.54 10.88 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.679 -0.691 . . . . 5.54 110.905 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' SER . . . . . 0.495 ' O ' ' HB2' ' B' ' 62' ' ' LEU . 15.6 m -132.94 108.61 9.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.676 -0.49 . . . . 6.13 109.676 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' B' ' 61' ' ' SER . 85.1 mt . . . . . 0 C--O 1.251 1.172 0 O-C-N 124.417 1.073 . . . . 8.07 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.418 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.121 -2.557 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.508 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.598 0 O4'-C1'-C2' 104.143 -1.779 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.508 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 99.278 -2.444 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.637 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.974 0 C3'-C2'-C1' 99.636 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.637 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.642 -2.184 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.46 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.462 1.422 0 O4'-C1'-C2' 103.997 -1.912 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.46 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.616 -2.203 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-C2' 103.705 -2.177 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.479 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.147 0 O4'-C1'-C2' 103.716 -2.167 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.479 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.241 0 C3'-C2'-C1' 100.046 -1.896 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.584 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 P--O3' 1.628 1.72 0 C3'-C2'-C1' 99.918 -1.987 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.011 0 C3'-C2'-C1' 98.903 -2.712 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.673 0 C3'-C2'-C1' 99.389 -2.365 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.531 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.768 -2.094 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.531 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.911 0 C3'-C2'-C1' 99.381 -2.371 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.45 -2.321 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.585 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.88 0 C3'-C2'-C1' 99.746 -2.11 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.585 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.791 -2.792 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.462 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 O4'-C1'-C2' 104.067 -1.848 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.597 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 99.606 -2.21 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.971 0 C3'-C2'-C1' 98.723 -2.84 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.235 0 C3'-C2'-C1' 99.48 -2.3 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 116.07 1.169 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.409 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.519 0.998 0 C3'-C2'-C1' 98.911 -2.707 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.409 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.11 0 C3'-C2'-C1' 100.923 -1.269 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.447 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 100.04 -1.9 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.447 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.991 0 O4'-C1'-N19 108.899 1.374 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.473 H2'' ' C7 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.13 0 C3'-C2'-C1' 105.205 1.789 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.473 ' C7 ' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.532 0.81 0 C3'-C2'-C1' 105.988 2.349 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.89 -1.1 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.042 0 C3'-C2'-C1' 105.51 2.007 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.493 ' C6 ' " H2'" ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.417 -1.439 0 C1'-O4'-C4' 110.427 0.52 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.615 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.419 -1.317 0 C3'-C2'-C1' 99.306 -2.424 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.615 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.536 0.785 0 C4'-C3'-C2' 104.902 1.702 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.522 " H4'" HD21 ' A' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.872 1.045 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.662 ' OP1' ' HA ' ' A' ' 49' ' ' PRO . . . . . . . . 0 O4'--C1' 1.399 -1.591 0 C1'-O4'-C4' 106.902 -1.998 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.504 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 O4'-C1'-C2' 104.884 -1.105 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.687 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.877 0 C3'-C2'-C1' 106.081 2.415 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.687 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.317 0 C3'-C2'-C1' 104.841 1.529 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.437 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 105.043 -0.961 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.025 0 O4'-C4'-C3' 106.372 0.772 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.573 ' C6 ' ' H73' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.757 0.973 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.573 ' H73' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-N19 108.291 0.613 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.498 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.897 -2.002 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.405 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.497 1.297 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptt? . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.423 -0.214 . . . . 6.16 110.423 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt 62.9 96.16 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.327 0 C-N-CA 123.118 0.567 . . . . 5.73 111.377 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.17 176.7 5.99 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.523 2.149 . . . . 3.0 112.859 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.53 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.54 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 1.28 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 1.67 111.591 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 2.35 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB2' HG13 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.67 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.418 ' HA ' HD11 ' A' ' 45' ' ' LEU . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 1.28 110.225 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 16' ' ' SER . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 1.32 111.752 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.4 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 2.19 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 1.21 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.37 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 1.38 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.33 109.393 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 2.05 111.075 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 2.09 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 1.32 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.482 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.99 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.08 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.402 ' HG3' ' HB1' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 3.11 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 2.18 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.96 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.61 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.81 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.402 ' HB1' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.6 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 2.06 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.56 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.59 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.58 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.432 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.67 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 2.24 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.61 ' O ' HG21 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 1.35 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.91 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.92 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.61 HG21 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 2.11 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.87 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 1.39 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 1.34 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 2.06 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 1.5 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.418 HD11 ' HA ' ' A' ' 9' ' ' VAL . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 1.51 111.45 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.36 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.53 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.98 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 2.28 108.608 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 1.03 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.416 HD21 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.34 109.379 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.527 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 5.46 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 1.18 110.002 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.527 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.65 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.78 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.451 HD22 ' N2 ' ' D' ' 12' ' ' ' DG' . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 1.44 112.135 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.46 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.66 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' GLY . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 5.25 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.549 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER 88.92 -12.19 0.41 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.34 111.853 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.16 10.34 36.27 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.323 0.583 . . . . 4.14 110.634 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-N 115.533 -0.758 . . . . 7.41 111.53 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 109.416 -0.587 . . . . 7.3 109.416 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 42.6 mtmt -76.68 118.82 74.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.669 -0.241 . . . . 6.75 110.809 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.543 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo -83.98 -5.63 10.48 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.986 1.791 . . . . 2.49 112.142 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.53 HG22 ' O ' ' B' ' 3' ' ' PRO . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 2.01 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.638 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 1.41 110.091 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.453 HD21 ' CE1' ' B' ' 47' ' ' TYR . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 1.26 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 2.13 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.94 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.504 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.66 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 1.4 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.89 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 2.26 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 1.29 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 1.22 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.14 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.56 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.493 ' HG2' ' N7 ' ' D' ' 5' ' ' ' DG' . 10.1 tp60 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.9 112.228 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 1.33 110.893 -179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.77 110.016 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.25 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.466 ' HG3' HE21 ' B' ' 18' ' ' GLN . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 2.4 110.495 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.97 109.849 178.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.64 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.85 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.82 110.972 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.55 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.37 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 2.38 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.92 111.351 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.412 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.9 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.74 109.442 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.67 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.45 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.95 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.94 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.429 HG21 ' N ' ' B' ' 39' ' ' GLU . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 2.03 112.599 -178.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.07 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 1.57 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 1.13 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.91 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.46 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 1.36 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.93 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.504 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.91 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.543 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 2.22 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.496 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.32 110.044 178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.613 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.85 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.83 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 1.26 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.57 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.613 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.03 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.486 ' C ' ' H ' ' B' ' 58' ' ' GLY . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.79 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 1.3 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.486 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 94.08 28.1 11.35 Favored Glycine 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.09 113.668 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -125.57 21.35 7.8 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.072 -0.714 . . . . 6.26 109.072 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -65.63 126.53 28.67 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.62 -0.718 . . . . 5.54 110.128 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 20.4 m -146.91 53.82 1.09 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.34 -0.845 . . . . 6.13 110.092 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 tp . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.677 -0.692 . . . . 8.07 109.649 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.438 " H2'" HO5' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.5 -1.465 0 C3'-C2'-C1' 98.929 -2.693 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.407 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.053 0 C3'-C2'-C1' 99.704 -2.14 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.407 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.619 0.987 0 C3'-C2'-C1' 99.877 -2.016 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.569 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.597 -2.217 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.569 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 C3'-C2'-C1' 99.131 -2.549 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.47 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 O4'-C1'-C2' 103.738 -2.147 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.47 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.144 0 C3'-C2'-C1' 99.567 -2.238 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 C3'-C2'-C1' 99.35 -2.393 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 C3'-C2'-C1' 99.185 -2.511 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.301 0 C3'-C2'-C1' 99.788 -2.08 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.117 0 O4'-C1'-C2' 103.972 -1.935 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.496 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 100.225 -1.768 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.638 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.42 " C2'" ' H73' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 C3'-C2'-C1' 99.677 -2.159 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.684 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.806 0 C3'-C2'-C1' 99.361 -2.385 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.684 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 99.677 -2.16 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 99.47 -2.307 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.557 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.81 -2.064 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.557 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.943 0 C3'-C2'-C1' 99.138 -2.544 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.565 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 C3'-C2'-C1' 99.49 -2.293 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.565 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 100.074 -1.876 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.552 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 99.403 -2.355 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 99.253 -2.462 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 N19-C1'-C2' 116.261 1.288 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.71 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 C3'-C2'-C1' 99.058 -2.601 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.71 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C4'-C3'-C2' 101.881 -1.319 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.555 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 100.485 -1.582 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.555 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.821 0 C3'-C2'-C1' 105.141 1.743 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.493 ' N7 ' ' HG2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 105.474 1.982 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.59 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.041 0 C3'-C2'-C1' 100.645 -1.468 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.59 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.866 0 O3'-P-O5' 102.746 -0.66 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.462 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 N19-C1'-C2' 116.352 1.345 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.641 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C4'-C3'-C2' 101.778 -1.422 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.641 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 102.048 -0.465 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.474 ' C8 ' " C2'" ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.526 0.772 0 C3'-C2'-C1' 105.265 1.832 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.525 ' C6 ' ' H71' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 105.202 1.787 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.525 ' H71' ' C6 ' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 O4'-C4'-C3' 106.339 0.739 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 101.396 -0.931 . . . . 1.17 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.417 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.728 0 C3'-C2'-C1' 101.239 -1.043 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.417 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.673 -0.734 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C4'-C3'-C2' 104.093 0.893 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.497 " H2'" ' H73' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.849 0 C3'-C2'-C1' 101.011 -1.206 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.522 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.782 0 C4'-C3'-C2' 104.364 1.164 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.522 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.407 -1.638 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.491 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 N19-C1'-C2' 115.377 0.736 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 110.643 -0.132 . . . . 6.16 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.434 ' HD3' ' CB ' ' A' ' 46' ' ' ASN . 47.4 mtpt -132.12 144.91 55.11 Favored Pre-proline 0 N--CA 1.468 0.429 0 N-CA-C 110.32 -0.252 . . . . 5.73 110.32 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -70.33 61.12 2.03 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.488 2.125 . . . . 3.0 113.271 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.54 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 1.28 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.531 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 1.67 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 2.35 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.67 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 1.28 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.593 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 1.32 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.4 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 2.19 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 1.21 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.37 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 1.38 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.593 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.33 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.531 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 2.05 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 2.09 110.501 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 1.32 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.459 HG21 ' N ' ' A' ' 21' ' ' SER . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.99 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.459 ' N ' HG21 ' A' ' 20' ' ' VAL . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.08 111.995 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 3.11 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 2.18 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.96 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.61 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.81 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.6 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 2.06 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.56 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.59 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.58 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.67 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 2.24 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.512 ' O ' HG22 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 1.35 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.91 110.016 178.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.92 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 2.11 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.87 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 1.39 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 1.34 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 2.06 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 1.5 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 1.51 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.434 ' CB ' ' HD3' ' A' ' 2' ' ' LYS . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.36 110.3 -178.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.98 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 2.28 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 1.03 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.34 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.458 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 5.46 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.524 ' CA ' HD12 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 1.18 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.65 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.561 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.78 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.73 HD22 ' C2 ' ' C' ' 11' ' ' ' DG' . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 1.44 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.46 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.66 113.245 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 5.25 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.519 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 -36.11 115.69 0.35 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.34 114.015 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.58 33.0 4.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.76 -0.654 . . . . 4.14 109.705 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.059 -0.972 . . . . 7.41 109.949 -179.005 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.166 -0.309 . . . . 7.3 110.166 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.415 ' HB3' ' HD3' ' B' ' 3' ' ' PRO . 11.3 tptm -168.28 -50.41 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.882 -0.58 . . . . 6.75 111.957 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' B' ' 2' ' ' LYS . 44.9 Cg_exo -56.62 100.57 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 122.079 1.853 . . . . 2.49 112.414 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.408 HG23 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 2.01 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.436 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 1.41 110.617 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 1.26 107.61 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 2.13 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.94 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.66 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 1.4 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.89 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 2.26 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 1.29 113.89 -177.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 1.22 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.496 ' O ' HG22 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.14 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.56 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.9 110.975 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 1.33 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.496 HG22 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.77 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.25 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 2.4 110.348 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.472 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.97 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.64 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.85 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.481 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.82 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.481 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.55 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.37 114.186 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 2.38 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.472 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.92 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.526 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.9 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.74 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.67 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.526 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.45 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.95 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.94 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.428 ' CG2' HG12 ' B' ' 23' ' ' VAL . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 2.03 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.07 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 1.57 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 1.13 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.91 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.46 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 1.36 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.93 112.233 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.408 ' HA ' HG23 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.91 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.414 ' HB ' ' HB3' ' B' ' 3' ' ' PRO . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 2.22 108.332 179.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.415 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.444 ' H ' H5'' ' C' ' 12' ' ' ' DA' . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.32 108.907 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.85 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.83 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 1.26 109.969 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.57 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.03 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.524 HD12 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.79 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 1.3 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.56 ' O ' ' HG3' ' B' ' 59' ' ' LYS . . . 99.36 104.7 2.56 Favored Glycine 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.09 109.099 -176.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' B' ' 58' ' ' GLY . 11.3 mtpp 171.95 -38.1 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.791 1.236 . . . . 6.26 109.664 -178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -149.33 39.36 0.82 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.145 -1.057 . . . . 5.54 108.145 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -69.63 100.26 1.43 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.761 -0.654 . . . . 6.13 111.152 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.527 -0.749 . . . . 8.07 111.348 -179.835 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 C3'-C2'-C1' 99.546 -2.253 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.49 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.058 0 C3'-C2'-C1' 99.196 -2.503 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.49 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.543 0 O4'-C1'-C2' 103.863 -2.033 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.436 " C2'" ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.466 -2.31 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.436 ' H72' " C2'" ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 98.574 -2.947 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.524 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 C3'-C2'-C1' 100.036 -1.903 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.524 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.868 0 C3'-C2'-C1' 99.499 -2.287 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.078 0 C3'-C2'-C1' 99.225 -2.482 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 99.453 -2.32 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.564 0 C3'-C2'-C1' 99.552 -2.248 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.716 -2.132 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.73 ' C2 ' HD22 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 100.073 -1.877 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.548 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 98.873 -2.733 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.447 H2'' ' H73' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.842 0 O4'-C1'-C2' 103.797 -2.094 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.447 ' H73' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.427 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.983 0 O4'-C1'-C2' 103.996 -1.912 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.721 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.436 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.201 0 C3'-C2'-C1' 99.806 -2.067 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.45 " H1'" ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.45 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 99.303 -2.426 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.497 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.109 0 C3'-C2'-C1' 99.927 -1.981 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 C3'-C2'-C1' 99.241 -2.47 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.245 -1.753 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.632 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 100.153 -1.819 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.632 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O4'-C1'-C2' 107.206 1.006 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.516 " H2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.806 0 C3'-C2'-C1' 105.619 2.085 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.516 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C4'-C3'-C2' 104.374 1.174 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.641 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.756 0 C3'-C2'-C1' 105.135 1.739 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.641 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.554 1.354 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.499 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 105.572 2.052 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.499 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C3'-C2'-C1' 100.31 -1.707 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-O3' 113.998 1.681 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.44 1.24 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.58 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.53 1.177 0 C3'-C2'-C1' 104.752 1.466 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.552 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 104.93 1.593 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.78 0 N19-C1'-C2' 116.14 1.212 . . . . 1.15 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.875 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 106.669 2.835 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.875 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.716 0 C3'-C2'-C1' 101.325 -0.982 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.429 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.583 0 N19-C1'-C2' 115.585 0.866 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.411 ' C5 ' ' C4 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 106.855 0.687 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.411 ' C4 ' ' C5 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 N19-C1'-C2' 115.36 0.725 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.507 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.718 0 O4'-C1'-C2' 104.721 -1.254 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.507 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 N19-C1'-C2' 115.205 0.628 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-C2' 105.372 -0.662 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 ttp . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.915 0.388 . . . . 6.16 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.432 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 34.7 mttm -85.53 136.6 37.11 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 116.072 -0.513 . . . . 5.73 111.04 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 5.8 Cg_exo -75.94 100.18 1.35 Allowed 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.838 2.359 . . . . 3.0 111.606 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.406 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.54 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 1.28 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.47 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 1.67 112.311 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 2.35 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.67 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 1.28 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 1.32 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.4 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 2.19 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 1.21 112.96 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.37 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 1.38 109.956 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.33 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 20' ' ' VAL . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 2.05 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 2.09 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 1.32 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 17' ' ' TYR . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.99 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.08 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 3.11 111.233 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 2.18 109.984 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.41 HG13 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.96 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.597 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.61 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.597 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.81 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.6 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 2.06 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.56 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.59 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.58 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.67 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 2.24 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 1.35 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.532 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.91 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.92 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 2.11 111.971 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.87 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 1.39 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 1.34 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 2.06 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 1.5 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 1.51 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.36 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.98 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 2.28 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 1.03 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.34 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 5.46 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 1.18 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.65 112.441 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.78 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.467 ' CD2' HD13 ' B' ' 56' ' ' LEU . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 1.44 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.46 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.66 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 5.25 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -104.4 9.73 35.61 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.34 111.111 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.548 ' OG ' ' HA ' ' B' ' 1' ' ' MET . 18.5 m -104.73 70.28 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.318 0.58 . . . . 4.14 110.14 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 C--O 1.246 0.9 0 CA-C-N 115.386 -0.825 . . . . 7.41 109.725 -179.801 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.548 ' HA ' ' OG ' ' A' ' 61' ' ' SER . 39.6 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.735 0.302 . . . . 7.3 110.711 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -109.51 102.04 48.25 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 6.75 109.923 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -86.87 -158.26 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.967 2.445 . . . . 2.49 112.951 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 2.01 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.487 ' O ' HG22 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 1.41 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.584 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 1.26 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.422 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 2.13 109.548 178.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.94 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.487 HG22 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.66 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 1.4 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.89 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.548 ' CD1' ' HB1' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 2.26 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 1.29 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.487 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 1.22 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.14 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.56 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.52 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.9 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' THR . . . . . 0.442 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 1.33 111.774 -179.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.407 ' C ' ' H ' ' B' ' 22' ' ' ARG . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.77 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.499 ' O ' HG13 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.25 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 2.4 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.97 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.499 HG13 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.64 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.426 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.85 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.561 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.82 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.561 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.55 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.37 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 77.2 m80 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 2.38 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.446 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.92 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.9 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.692 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.74 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.67 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.45 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.692 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.95 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.94 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.487 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 2.03 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.07 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 1.57 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.548 ' HB1' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 1.13 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' MET . . . . . 0.58 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.91 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.46 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 1.36 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.93 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.584 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.91 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 2.22 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.32 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' B' ' 62' ' ' LEU . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.85 110.44 -178.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.485 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.83 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 1.26 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.57 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.798 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.03 112.262 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.79 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 1.3 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.24 -2.44 16.45 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.09 113.792 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.798 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 58.7 mmtt -96.44 85.61 3.96 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.159 -0.682 . . . . 6.26 109.159 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -83.74 56.77 3.78 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.233 0.539 . . . . 5.54 111.244 -177.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.85 -15.96 23.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.582 -0.736 . . . . 6.13 110.469 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.439 ' O ' ' HD2' ' B' ' 51' ' ' ARG . 2.1 mm? . . . . . 0 C--O 1.249 1.026 0 CA-C-O 117.767 -1.111 . . . . 8.07 110.182 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.485 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.582 -2.227 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.485 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.255 0 C3'-C2'-C1' 99.679 -2.158 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.453 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C1'-C2' 103.807 -2.084 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.618 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 99.076 -2.589 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.618 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.281 -2.442 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.405 ' C8 ' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-C2' 103.889 -2.01 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.483 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 C3'-C2'-C1' 99.027 -2.624 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.483 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.086 0 C3'-C2'-C1' 99.028 -2.623 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.48 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.823 0 C3'-C2'-C1' 99.652 -2.177 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.419 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 O4'-C1'-C2' 103.932 -1.971 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.557 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 103.797 -2.094 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.557 ' C8 ' H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.495 ' N7 ' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.068 0 C3'-C2'-C1' 99.005 -2.64 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.135 0 C3'-C2'-C1' 99.85 -2.036 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.314 -2.418 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.452 -2.32 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.912 0 C3'-C2'-C1' 99.823 -2.055 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.474 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 98.711 -2.85 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.474 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 C3'-C2'-C1' 99.634 -2.19 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.454 ' C4 ' ' C5 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.583 -2.227 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.459 ' C2 ' ' C5 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.459 ' C5 ' ' C2 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.092 0 C3'-C2'-C1' 99.437 -2.331 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O5'-P-OP1 106.798 -0.449 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.429 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C3'-C2'-C1' 99.594 -2.219 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.429 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.734 0 C4'-C3'-C2' 102.619 -0.581 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.562 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.731 -1.406 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.562 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.726 0 O4'-C1'-C2' 105.098 -0.911 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.416 H2'' ' C7 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 101.894 -0.576 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.416 ' C7 ' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 N19-C1'-C2' 115.674 0.921 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.004 0 C1'-O4'-C4' 106.821 -2.056 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.55 2.036 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.583 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 100.702 -1.427 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.406 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.059 -2.601 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.479 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 101.952 -0.534 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.514 ' C8 ' ' C5 ' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.893 0 C4'-C3'-C2' 104.648 1.448 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.514 ' C5 ' ' C8 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.439 -0.642 0 C1'-O4'-C4' 106.843 -2.041 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.513 H2'' ' OP2' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-C2' 105.157 -0.858 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.676 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.525 0.684 0 C3'-C2'-C1' 106.251 2.536 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.676 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C4'-C3'-C2' 103.934 0.734 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.82 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.441 0.774 0 C3'-C2'-C1' 105.273 1.838 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.82 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.631 1.967 0 C3'-C2'-C1' 104.916 1.583 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.143 -1.112 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C1'-O4'-C4' 107.321 -1.7 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.547 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C3'-C2'-C1' 100.205 -1.782 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C5'-C4'-O4' 108.204 -0.748 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 tpt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.935 0.398 . . . . 6.16 111.194 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 37.7 mmtt -124.17 125.56 25.72 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.608 -0.269 . . . . 5.73 110.402 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 7.5 Cg_exo -70.06 98.37 0.71 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.106 1.871 . . . . 3.0 110.666 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.54 109.987 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 1.28 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.591 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 1.67 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 2.35 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.67 109.735 -179.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 1.28 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 1.32 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.4 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 2.19 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 1.21 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.37 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 1.38 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.33 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.591 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 2.05 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 2.09 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 1.32 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.424 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.99 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.08 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.437 ' HD3' HG22 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 3.11 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.459 ' HA ' ' HB3' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 2.18 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.96 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.493 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.61 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.493 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.81 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.459 ' HB3' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.6 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 2.06 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.56 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.437 HG22 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.59 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.42 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.58 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.67 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 2.24 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 1.35 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.91 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.92 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.424 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 2.11 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.87 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 1.39 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 1.34 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 2.06 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.401 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 1.5 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 1.51 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.36 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.98 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 2.28 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 1.03 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.477 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.34 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.455 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 5.46 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 1.18 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.517 ' HG2' ' OP1' ' D' ' 14' ' ' ' DT' . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.65 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.613 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.78 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 1.44 113.506 -179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.46 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.66 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.522 ' HZ1' " C3'" ' D' ' 14' ' ' ' DT' . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 5.25 112.589 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.613 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER 64.73 -167.35 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.34 110.191 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 -47.84 13.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.571 0.224 . . . . 4.14 110.776 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.586 -0.721 . . . . 7.41 110.212 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.895 0.379 . . . . 7.3 111.252 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -77.82 140.07 62.65 Favored Pre-proline 0 N--CA 1.45 -0.432 0 CA-C-N 115.997 -0.547 . . . . 6.75 111.023 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 154.41 47.26 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.725 2.284 . . . . 2.49 112.814 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.418 HG22 ' HA ' ' B' ' 47' ' ' TYR . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 2.01 109.77 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 1.41 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.436 HD23 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 1.26 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 2.13 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.94 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.66 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.57 ' HB3' ' CG2' ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 1.4 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.89 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 2.26 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . 0.424 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 1.29 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 1.22 109.506 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.14 110.671 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.56 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.9 109.456 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 1.33 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.57 ' CG2' ' HB3' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.77 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.622 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.25 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 2.4 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.586 HG13 ' N ' ' B' ' 24' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.97 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.586 ' N ' HG13 ' B' ' 23' ' ' VAL . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.64 107.32 177.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.622 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.85 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.82 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.55 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.37 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 2.38 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.92 114.032 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.9 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.417 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.74 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.67 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.45 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.95 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.94 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.424 ' HA ' ' CB ' ' B' ' 13' ' ' ALA . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 2.03 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.07 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 1.57 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 1.13 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.91 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.46 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 1.36 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.93 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.418 ' HA ' HG22 ' B' ' 4' ' ' VAL . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.91 112.046 178.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 2.22 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.32 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.597 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.85 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.83 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 1.26 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.57 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.597 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.03 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.524 ' HG ' ' O2 ' ' D' ' 11' ' ' ' DC' . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.79 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 1.3 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . -146.05 -97.79 0.22 Allowed Glycine 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.09 110.107 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -145.95 6.61 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.581 0.215 . . . . 6.26 111.581 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.85 113.68 26.02 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.401 0.62 . . . . 5.54 111.633 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -66.85 -44.44 81.02 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.063 -0.972 . . . . 6.13 110.494 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.11 -0.947 . . . . 8.07 110.157 -179.678 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.565 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.83 0 C3'-C2'-C1' 99.314 -2.419 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.119 0 C3'-C2'-C1' 99.73 -2.121 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.512 -0.663 0 C3'-C2'-C1' 99.696 -2.146 . . . . 1.52 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.514 " C2'" ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.9 0 C3'-C2'-C1' 99.917 -1.988 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.514 ' H72' " C2'" ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.06 0 C3'-C2'-C1' 99.394 -2.362 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.457 H2'' ' C6 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.815 0 C3'-C2'-C1' 99.509 -2.279 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.457 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.029 0 C3'-C2'-C1' 98.861 -2.742 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.568 H2'' ' C5 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.503 -1.316 0 O4'-C1'-C2' 104.038 -1.875 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.568 ' C5 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.955 -1.95 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.568 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 C3'-C2'-C1' 100.24 -1.757 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.568 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.047 0 C3'-C2'-C1' 99.168 -2.523 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.752 0 O4'-C1'-C2' 103.691 -2.19 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.468 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.063 0 C3'-C2'-C1' 99.251 -2.463 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.468 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.956 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.459 -2.315 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.409 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.887 0 C3'-C2'-C1' 99.725 -2.125 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.49 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.99 -2.65 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.49 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.175 -2.518 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.622 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.182 0 C3'-C2'-C1' 99.97 -1.95 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.622 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.297 -2.431 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.033 0 C3'-C2'-C1' 99.51 -2.279 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.329 0.705 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.443 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 99.789 -2.079 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.443 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C2'-C3'-O3' 112.397 0.665 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.567 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 105.385 1.918 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.567 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 OP2-P-O3' 110.137 0.574 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 104.641 1.386 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.828 1.52 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C1'-O4'-C4' 107.369 -1.665 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.432 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 105.37 1.907 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.537 ' C6 ' ' H72' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 N19-C1'-C2' 115.134 0.584 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.537 ' H72' ' C6 ' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 105.297 1.855 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.536 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.453 1.253 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.103 1.189 . . . . 1.19 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.467 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.406 -1.04 0 C1'-O4'-C4' 106.607 -2.21 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.522 " C3'" ' HZ1' ' A' ' 59' ' ' LYS . . . . . . . . 0 C2'--C1' 1.507 -1.006 0 C1'-O4'-C4' 107.656 -1.46 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.511 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O3'-P-O5' 102.594 -0.74 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.45 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.926 -1.267 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.515 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C4'-C3'-C2' 105.091 1.891 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.515 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.618 0.953 0 C5'-C4'-C3' 116.284 1.056 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.453 ' OP2' H2'' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 O4'-C1'-C2' 104.88 -1.109 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.44 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 106.083 0.483 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.44 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C3'-C2'-C1' 99.807 -2.066 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.407 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 N19-C1'-C2' 116.11 1.194 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 73.4 mtp . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.074 0.464 . . . . 6.16 110.331 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 45' ' ' LEU . 58.9 mtpt -122.11 145.81 44.92 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.724 -0.472 . . . . 5.73 109.724 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -80.79 58.86 7.22 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.182 1.922 . . . . 3.0 111.913 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.52 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.54 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 1.28 110.614 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 1.67 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 2.35 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.67 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 1.28 109.588 177.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 1.32 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.4 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 2.19 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 1.21 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.37 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 1.38 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.33 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.442 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 2.05 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 2.09 109.972 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 1.32 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.99 111.223 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.08 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HB3' HG22 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 3.11 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.468 ' HB ' HG13 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 2.18 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.96 109.947 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.61 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.81 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.6 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 2.06 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.409 ' O ' HG23 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.56 109.216 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.59 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.58 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.67 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 2.24 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.434 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 1.35 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.91 110.843 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.92 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.468 HG13 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 2.11 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.87 111.237 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 1.39 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 1.34 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 2.06 111.11 -178.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 1.5 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.43 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 1.51 110.71 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.516 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.36 110.512 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.52 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.98 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 2.28 109.882 177.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 1.03 113.453 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.34 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 5.46 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.47 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 1.18 109.242 178.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.65 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.78 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.492 HD12 " O4'" ' C' ' 11' ' ' ' DG' . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 1.44 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.46 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.66 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 5.25 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.2 OUTLIER 66.0 81.39 0.2 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.34 110.212 179.284 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.4 m -110.42 111.91 23.49 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.935 -0.395 . . . . 4.14 109.935 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.608 0 CA-C-O 118.124 -0.941 . . . . 7.41 110.546 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.6 mmt . . . . . 0 N--CA 1.483 1.178 0 CA-C-O 120.951 0.405 . . . . 7.3 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -83.5 160.41 59.26 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 116.359 -0.382 . . . . 6.75 110.073 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.04 94.24 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.93 2.42 . . . . 2.49 112.291 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 2.01 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.51 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 1.41 111.842 -178.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 1.26 108.725 178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.51 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 2.13 109.941 177.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.94 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.66 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 1.4 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.89 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.414 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 2.26 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 1.29 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 1.22 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.425 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.14 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.56 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.442 ' HB3' ' C7 ' ' D' ' 6' ' ' ' DT' . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.9 111.299 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 1.33 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.425 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.77 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.25 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 2.4 110.279 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.452 HG21 HG22 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.97 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.64 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.85 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.82 111.241 -179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.55 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.37 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 2.38 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.92 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.9 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.74 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.67 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.95 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.558 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.94 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.452 HG22 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 2.03 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.558 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.07 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 1.57 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 1.13 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' MET . . . . . 0.458 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.91 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.46 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 1.36 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.93 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.91 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 2.22 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.545 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.32 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.85 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.83 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 1.26 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.57 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.03 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.531 HD23 ' C2 ' ' D' ' 12' ' ' ' DG' . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.79 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 1.3 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.18 -90.13 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.09 111.539 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.418 ' HE3' ' HB3' ' B' ' 59' ' ' LYS . 24.8 mtpp -150.8 -91.18 0.06 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.534 0.683 . . . . 6.26 110.491 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -122.15 70.01 0.96 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.163 -0.926 . . . . 5.54 110.399 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.48 103.31 15.23 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.496 -0.557 . . . . 6.13 109.496 179.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.243 0.753 0 CA-C-O 118.313 -0.851 . . . . 8.07 110.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.571 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 99.659 -2.172 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.571 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.191 0 O4'-C1'-C2' 103.582 -2.289 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.447 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.93 0 C3'-C2'-C1' 99.539 -2.258 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.497 ' C8 ' ' H71' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 99.156 -2.531 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.497 ' H71' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 98.801 -2.785 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.618 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 99.478 -2.301 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.618 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.73 0 C3'-C2'-C1' 99.364 -2.383 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.507 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 99.541 -2.257 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.813 0 C3'-C2'-C1' 99.007 -2.638 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.573 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 O4'-C1'-C2' 103.796 -2.095 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.531 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.252 0 C3'-C2'-C1' 99.514 -2.276 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.531 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.269 0 C3'-C2'-C1' 99.105 -2.568 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 C3'-C2'-C1' 100.027 -1.909 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 C3'-C2'-C1' 99.329 -2.408 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 99.608 -2.208 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 100.072 -1.877 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.534 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.534 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 99.415 -2.347 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.444 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 C3'-C2'-C1' 99.271 -2.449 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.417 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.84 0 C3'-C2'-C1' 99.424 -2.34 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.403 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.275 -2.446 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.403 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.876 0 C3'-C2'-C1' 99.451 -2.321 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . 0.514 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.437 0.474 0 O4'-C4'-C3' 106.672 1.072 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.514 ' C8 ' H2'' ' D' ' -1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.62 1.122 0 C3'-C2'-C1' 98.02 -3.343 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C5'-C4'-C3' 116.356 1.104 . . . . 1.97 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.648 " H2'" ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C3'-C2'-C1' 105.532 2.023 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.648 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C4'-C3'-C2' 104.505 1.305 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 N19-C1'-C2' 115.575 0.86 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.62 H2'' " O5'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.875 0 C3'-C2'-C1' 105.673 2.124 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.007 0 C1'-O4'-C4' 107.83 -1.336 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 100.96 -1.243 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.528 ' C6 ' ' H72' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 104.908 1.577 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.572 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.422 -1.118 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.146 0 P-O3'-C3' 120.779 0.899 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.731 " H1'" " O4'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.529 1.068 0 C3'-C2'-C1' 105.203 1.788 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.731 " O4'" " H1'" ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.403 -1.321 0 C1'-O4'-C4' 106.016 -2.632 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.423 H2'' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.528 0.976 0 O4'-C1'-C2' 104.782 -1.198 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.656 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.312 1.866 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.539 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.423 -1.065 0 C3'-C2'-C1' 100.994 -1.218 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.539 ' C5 ' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 N19-C1'-C2' 115.405 0.753 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.864 0 O4'-C4'-C3' 106.327 0.727 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 N19-C1'-C2' 116.091 1.182 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.055 0 C1'-O4'-C4' 107.574 -1.519 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.573 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 99.737 -2.117 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.573 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.163 0 C1'-O4'-C4' 107.307 -1.709 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.027 -0.36 . . . . 6.16 110.027 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 106.33 57.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.362 -0.381 . . . . 5.73 110.036 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.87 134.81 45.12 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.68 2.253 . . . . 3.0 111.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.409 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.54 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 1.28 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.505 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 1.67 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 2.35 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.67 109.385 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 1.28 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 1.32 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.4 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 2.19 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 1.21 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.37 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 1.38 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.33 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.505 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 2.05 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 2.09 110.254 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 1.32 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.495 ' O ' HG21 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.99 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.08 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 3.11 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 2.18 110.527 -178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.96 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.61 109.874 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.81 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.6 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 2.06 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.56 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.59 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.58 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.67 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 2.24 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 1.35 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.91 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.92 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 2.11 110.899 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.87 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 1.39 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 1.34 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 2.06 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 1.5 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' HG13 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 1.51 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.36 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.409 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.98 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 2.28 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 1.03 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.57 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.34 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 5.46 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.404 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.402 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 1.18 110.096 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.57 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.65 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.78 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.481 HD22 ' N2 ' ' D' ' 12' ' ' ' DG' . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 1.44 112.076 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.46 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.66 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.554 ' O ' HD22 ' A' ' 62' ' ' LEU . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 5.25 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -45.73 -54.04 8.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.34 111.918 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.0 m -134.92 66.8 1.52 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.734 -0.469 . . . . 4.14 109.734 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.554 HD22 ' O ' ' A' ' 59' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.399 -0.81 . . . . 7.41 111.168 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 110.217 -0.29 . . . . 7.3 110.217 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -150.34 104.81 3.12 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.593 -0.276 . . . . 6.75 110.507 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -87.9 -159.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.753 2.302 . . . . 2.49 111.175 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 2.01 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.631 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 1.41 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 1.26 109.92 -179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 2.13 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.94 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.66 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 1.4 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.89 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 2.26 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 1.29 112.429 -178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 1.22 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.433 ' HG ' ' P ' ' D' ' 5' ' ' ' DG' . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.14 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.436 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.56 112.8 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.466 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.9 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' THR . . . . . 0.417 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 1.33 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.77 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.25 110.66 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.541 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 2.4 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.97 110.537 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.524 HG11 ' N ' ' B' ' 25' ' ' ASN . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.64 112.682 -178.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.524 ' N ' HG11 ' B' ' 24' ' ' VAL . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.85 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.448 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.82 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.541 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.55 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.37 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 2.38 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.45 HG22 ' O ' ' B' ' 27' ' ' ALA . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.92 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.503 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.9 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.74 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.67 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.45 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.95 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.94 111.943 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.431 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 2.03 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.07 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 1.57 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 1.13 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.91 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.46 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 1.36 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.93 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.91 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 2.22 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.32 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.85 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.83 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 1.26 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.57 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.03 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.47 ' C ' ' H ' ' B' ' 58' ' ' GLY . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.79 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 1.3 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.47 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 70.54 49.34 31.43 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.09 114.447 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.514 ' HZ3' " H4'" ' C' ' 13' ' ' ' DG' . 22.5 mtpp -83.15 -44.42 15.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.989 0.395 . . . . 6.26 110.413 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -95.11 111.95 23.71 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.14 -0.689 . . . . 5.54 109.14 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 26.2 m -77.0 -20.14 56.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.55 -0.295 . . . . 6.13 111.699 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--O 1.254 1.299 0 CA-C-O 118.226 -0.892 . . . . 8.07 111.456 178.914 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.416 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 99.383 -2.369 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.426 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.11 0 C3'-C2'-C1' 99.406 -2.353 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.426 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 99.922 -1.984 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.628 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.628 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.968 -2.666 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.56 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 103.942 -1.962 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.56 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C3'-C2'-C1' 99.104 -2.569 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 99.805 -2.068 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 98.721 -2.842 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.446 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.438 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.23 0 C3'-C2'-C1' 99.839 -2.043 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.621 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.689 -2.151 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.621 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 99.113 -2.562 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.514 " H4'" ' HZ3' ' B' ' 59' ' ' LYS . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.564 -2.24 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.423 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.694 0 O4'-C1'-C2' 103.692 -2.189 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.466 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 C3'-C2'-C1' 99.802 -2.07 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.085 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 99.618 -2.201 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.492 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.288 -2.437 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.492 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.537 -2.259 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.477 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 99.933 -1.977 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.477 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 C3'-C2'-C1' 99.182 -2.513 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.45 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.139 0 C3'-C2'-C1' 99.341 -2.399 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-P-OP1 106.661 -0.496 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 101.77 -0.664 . . . . 2.52 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 C4'-C3'-C2' 102.396 -0.804 . . . . 1.97 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.583 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C1'-O4'-C4' 107.591 -1.507 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.583 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.959 0 C4'-C3'-C2' 104.467 1.267 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.433 ' P ' ' HG ' ' B' ' 16' ' ' SER . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 C5'-C4'-C3' 116.29 1.06 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.424 " H5'" " H1'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 N19-C1'-C2' 115.946 1.091 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.563 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 104.319 1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.563 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 105.388 1.92 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.482 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-C2' 107.109 0.917 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.633 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 98.098 -3.287 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.633 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C4'-C3'-C2' 103.866 0.666 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.481 ' N2 ' HD22 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.529 1.134 0 C3'-C2'-C1' 104.775 1.482 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.463 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.965 0 C1'-O4'-C4' 107.495 -1.575 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.547 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.679 0 C3'-C2'-C1' 105.41 1.936 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 105.822 2.23 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.621 1.192 0 P-O3'-C3' 120.659 0.799 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.468 ' C2 ' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C3'-C2'-C1' 101.316 -0.989 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.732 0 C4'-C3'-C2' 103.988 0.788 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.584 ' C6 ' ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.584 ' H71' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 101.62 -0.772 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.362 -1.67 . . . . 2.18 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.961 0 C4'-C3'-C2' 104.547 1.347 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.373 0.13 . . . . 6.16 111.004 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.78 83.01 0.23 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 123.513 0.725 . . . . 5.73 111.272 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -63.39 140.35 76.01 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.245 1.964 . . . . 3.0 111.631 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.54 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 1.28 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.519 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 1.67 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.478 ' CE2' HD12 ' A' ' 6' ' ' LEU . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 2.35 110.368 -178.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.67 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 1.28 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.406 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 1.32 112.015 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.4 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 2.19 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 1.21 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 10' ' ' ALA . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.37 111.558 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 1.38 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.33 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 2.05 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 2.09 112.286 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 1.32 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.99 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.08 113.376 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.508 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 3.11 111.727 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 2.18 110.55 -179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.96 110.805 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.61 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.81 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.6 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 2.06 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.42 ' O ' HG22 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.56 108.264 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.42 HG22 ' O ' ' A' ' 29' ' ' HIS . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.59 111.865 -177.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.58 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.67 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 2.24 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 1.35 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.91 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.92 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 34' ' ' THR . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 2.11 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.87 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 1.39 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 1.34 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 2.06 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 1.5 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 1.51 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.36 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.556 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.98 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 2.28 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 1.03 111.804 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.425 HD21 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.34 110.169 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 5.46 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 1.18 110.694 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.65 112.742 -178.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.78 110.25 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.508 HD23 HD12 ' B' ' 56' ' ' LEU . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 1.44 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.46 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.66 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 5.25 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.518 ' NE2' H5'' ' C' ' 11' ' ' ' DG' . 0.5 OUTLIER 51.12 99.53 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.34 113.339 179.085 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -88.66 23.96 2.13 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.165 -0.334 . . . . 4.14 111.497 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.181 -0.914 . . . . 7.41 111.137 -179.827 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 44.9 mtp . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.782 0.325 . . . . 7.3 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -88.46 127.51 56.49 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.436 -0.347 . . . . 6.75 110.233 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.68 ' O ' HG21 ' B' ' 4' ' ' VAL . 87.4 Cg_endo -83.39 -10.47 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.902 2.401 . . . . 2.49 112.325 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.68 HG21 ' O ' ' B' ' 3' ' ' PRO . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 2.01 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.442 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 1.41 110.005 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.577 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 1.26 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 2.13 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.94 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.45 HG13 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.66 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 1.4 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.89 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 2.26 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . 0.444 ' HB3' HG22 ' B' ' 15' ' ' VAL . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 1.29 112.337 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.444 HG22 ' HB3' ' B' ' 13' ' ' ALA . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 1.22 109.991 -179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.14 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.463 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.56 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.9 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 1.33 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.77 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.25 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 2.4 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.97 109.538 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.64 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.85 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.82 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.55 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.37 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 2.38 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.92 109.831 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' SER . . . . . 0.507 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.9 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.551 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.74 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.67 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.507 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.45 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.95 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.94 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 2.03 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.07 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 1.57 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 1.13 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.91 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.46 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 1.36 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.93 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.577 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.91 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 2.22 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . 0.463 ' O ' H5'' ' C' ' 12' ' ' ' DA' . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.32 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.643 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.85 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.83 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 1.26 109.916 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.643 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.57 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.03 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.79 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 1.3 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . 0.417 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 93.09 38.73 5.34 Favored Glycine 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.09 113.787 177.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.446 ' HA ' ' HE2' ' B' ' 59' ' ' LYS . 9.2 mmpt? -87.79 -29.12 21.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.953 0.406 . . . . 6.26 110.327 178.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -119.99 101.27 7.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.859 -0.423 . . . . 5.54 109.859 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' SER . . . . . 0.418 ' C ' ' HG ' ' B' ' 62' ' ' LEU . 9.6 m -99.76 -10.08 22.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 6.13 111.68 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.418 ' HG ' ' C ' ' B' ' 61' ' ' SER . 2.1 mt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.099 -0.953 . . . . 8.07 109.878 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.082 -2.584 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.403 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.365 0 O4'-C1'-C2' 103.988 -1.92 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.446 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.703 0 C3'-C2'-C1' 99.666 -2.167 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.545 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.709 0 O4'-C1'-C2' 103.751 -2.135 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.706 H2'' ' C8 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 C3'-C2'-C1' 98.596 -2.931 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.706 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.722 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.459 ' H71' " C2'" ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.713 0 C3'-C2'-C1' 99.334 -2.404 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.402 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.891 -2.006 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.402 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.116 0 C3'-C2'-C1' 99.317 -2.416 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.5 -1.479 0 C3'-C2'-C1' 99.487 -2.295 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 103.953 -1.952 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.518 H5'' ' NE2' ' A' ' 60' ' ' GLN . . . . . . . . 0 P--O3' 1.621 1.125 0 C3'-C2'-C1' 99.496 -2.288 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.493 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.777 -2.088 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.52 H5'' ' HG3' ' B' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 103.745 -2.141 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.517 ' H73' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 98.74 -2.828 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.598 -0.784 0 C3'-C2'-C1' 99.247 -2.466 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 C3'-C2'-C1' 99.198 -2.501 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.612 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.701 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 99.162 -2.527 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.593 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.542 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.775 -2.089 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.542 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 99.573 -2.234 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.764 -2.097 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 100.884 -1.297 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.548 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 N19-C1'-C2' 116.527 1.454 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.548 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 101.684 -0.726 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.555 " H2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 105.232 1.809 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.644 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.871 -2.021 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.644 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.265 0 O4'-C1'-N19 108.47 0.837 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.472 ' C6 ' ' H71' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.878 0 C5'-C4'-C3' 116.747 1.364 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.472 ' H71' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 107.666 -1.453 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.995 0 C1'-O4'-C4' 107.853 -1.319 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.736 H2'' " O5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.805 0 C1'-O4'-C4' 107.144 -1.826 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.736 " O5'" H2'' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.007 -1.209 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.443 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.272 0.67 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.48 ' C5 ' ' C4 ' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C4'-C3'-C2' 104.557 1.357 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.48 ' C4 ' ' C5 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C1'-O4'-C4' 106.273 -2.448 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.677 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C3'-C2'-C1' 105.195 1.782 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.692 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.616 0.742 0 O4'-C4'-C3' 104.337 -1.263 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.502 ' C8 ' H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C4'-C3'-C2' 102.204 -0.996 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.511 H2'' ' N7 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.929 0 O4'-C1'-C2' 104.62 -1.345 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.511 ' N7 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 C3'-C2'-C1' 103.97 0.907 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 N19-C1'-C2' 116.66 1.538 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C1'-O4'-C4' 107.368 -1.665 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 N19-C1'-C2' 116.778 1.611 . . . . 2.18 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.412 -0.632 0 O4'-C4'-C3' 106.472 0.872 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 ttp . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.746 0.307 . . . . 6.16 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -86.54 120.14 71.82 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.644 -0.502 . . . . 5.73 109.644 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.26 114.32 1.97 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.17 1.913 . . . . 3.0 111.18 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.54 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.439 ' O ' HG22 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 1.28 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.478 HD11 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 1.67 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 2.35 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.67 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 1.28 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 1.32 111.149 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.4 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 2.19 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 1.21 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.37 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 1.38 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.33 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.478 ' O ' HD11 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 2.05 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 2.09 110.478 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 1.32 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.99 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.08 111.364 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 3.11 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 2.18 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.49 HG12 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.96 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.554 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.61 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.81 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.6 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 2.06 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.476 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.56 112.343 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.59 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.58 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.67 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 2.24 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 1.35 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.91 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.92 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 2.11 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.87 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 1.39 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 1.34 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.581 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 2.06 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 1.5 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 1.51 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.36 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.98 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.428 ' O ' HG13 ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 2.28 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 1.03 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.506 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.34 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.401 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 5.46 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.421 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 1.18 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.65 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.78 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.425 HD12 ' N3 ' ' C' ' 11' ' ' ' DG' . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 1.44 111.827 178.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.46 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.66 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 5.25 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -56.26 -31.44 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.34 111.304 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 70.24 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 4.14 111.136 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-N 115.814 -0.63 . . . . 7.41 109.796 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.003 0.43 . . . . 7.3 110.986 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -102.64 140.52 21.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 C-N-CA 120.829 -0.348 . . . . 6.75 110.522 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.51 -169.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.56 2.173 . . . . 2.49 111.938 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 2.01 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.471 ' O ' HG22 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 1.41 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 1.26 110.155 -179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 2.13 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.94 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.471 HG22 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.66 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 1.4 112.077 -179.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.89 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 2.26 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 1.29 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 1.22 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.457 ' HB2' ' H72' ' D' ' 6' ' ' ' DT' . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.14 112.6 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.56 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.9 111.509 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 1.33 111.856 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.77 111.255 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.25 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 2.4 111.156 178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.97 108.309 178.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' B' ' 26' ' ' GLN . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.64 110.436 179.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.85 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.409 ' H ' ' C ' ' B' ' 24' ' ' VAL . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.82 113.139 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.55 112.187 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.37 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 2.38 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.92 109.696 175.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.9 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.405 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.74 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.67 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.45 112.661 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.95 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.94 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 2.03 110.685 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.07 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 1.57 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 1.13 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.91 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.46 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 1.36 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.93 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.91 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 2.22 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.32 109.162 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.482 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.85 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.544 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.83 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 1.26 111.569 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.57 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.482 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.03 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.79 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 1.3 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.45 31.22 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.09 111.381 174.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.441 ' HE2' " H4'" ' C' ' 13' ' ' ' DG' . 24.6 mtmt -141.6 43.87 1.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.741 -0.229 . . . . 6.26 110.654 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.464 ' OE1' ' HG3' ' B' ' 55' ' ' GLN . 20.1 mm-40 -42.71 94.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.876 0.695 . . . . 5.54 112.876 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 4.6 p -106.36 -14.21 15.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.091 -0.504 . . . . 6.13 109.824 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.4 mt . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.979 -1.009 . . . . 8.07 111.506 179.862 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.263 0 C3'-C2'-C1' 99.297 -2.431 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.543 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.234 0 C3'-C2'-C1' 99.709 -2.136 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.543 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 O4'-C1'-C2' 103.939 -1.965 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.476 ' OP2' ' HA ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.626 -2.195 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.451 ' H71' " C2'" ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.917 0 C3'-C2'-C1' 99.108 -2.566 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.467 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.714 0 C3'-C2'-C1' 99.751 -2.106 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.473 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.09 0 C3'-C2'-C1' 98.714 -2.847 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.489 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.071 0 C3'-C2'-C1' 99.571 -2.235 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.489 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.023 0 C3'-C2'-C1' 99.107 -2.566 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.334 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 104.047 -1.866 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.555 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.908 0 C3'-C2'-C1' 99.891 -2.007 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.815 -2.775 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.453 ' C8 ' ' H73' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.844 0 C3'-C2'-C1' 99.739 -2.115 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.453 ' H73' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.802 0 C3'-C2'-C1' 99.493 -2.29 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 99.674 -2.161 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.61 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 99.673 -2.162 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.61 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.683 0 C3'-C2'-C1' 99.234 -2.476 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 99.651 -2.178 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.575 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.83 -2.05 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.575 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.425 -2.339 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.002 0 C3'-C2'-C1' 99.682 -2.155 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.854 0 C4'-C3'-C2' 104.247 1.047 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.571 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.022 -1.913 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.571 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.613 0.515 0 C4'-C3'-C2' 102.325 -0.875 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.455 " H2'" ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.456 1.968 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.455 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 100.81 -1.35 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 104.47 1.264 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.457 ' H72' ' HB2' ' B' ' 16' ' ' SER . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 104.139 1.028 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C1'-O4'-C4' 106.978 -1.944 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C4'-C3'-C2' 104.397 1.197 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 101.165 -1.097 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.541 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.443 0.937 0 C4'-C3'-C2' 104.586 1.386 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.541 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.622 1.273 0 P-O3'-C3' 120.89 0.992 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.421 ' C5 ' ' C4 ' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.405 -1.176 0 C4'-C3'-C2' 104.563 1.363 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.421 ' C4 ' ' C5 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.232 -1.763 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.576 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C3'-C2'-C1' 105.298 1.856 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.576 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.734 0 C3'-C2'-C1' 106.577 2.769 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.744 " H1'" " O4'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.277 0 C3'-C2'-C1' 105.567 2.048 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.744 " O4'" " H1'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.906 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 102.201 -0.999 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.198 -1.073 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C1'-O4'-C4' 106.962 -1.956 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.494 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C3'-C2'-C1' 101.062 -1.17 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.494 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 N19-C1'-C2' 115.248 0.655 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 tpp . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.577 0.227 . . . . 6.16 110.969 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -80.88 125.16 80.73 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.84 -0.43 . . . . 5.73 109.84 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.45 86.6 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.758 1.639 . . . . 3.0 111.667 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.54 108.983 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 1.28 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.518 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 1.67 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 2.35 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.67 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.416 HG12 ' HB1' ' A' ' 41' ' ' ALA . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 1.28 110.504 178.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' ' 16' ' ' SER . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 1.32 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.4 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 2.19 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 1.21 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.37 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 1.38 110.02 -178.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.558 ' O ' ' HB2' ' A' ' 10' ' ' ALA . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.33 110.895 178.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.518 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 2.05 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.506 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 8.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 2.09 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.418 HG22 HG22 ' A' ' 34' ' ' THR . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 1.32 110.381 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.656 ' O ' HG21 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.99 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.506 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 3.11 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.656 HG21 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 2.18 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.96 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.61 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.81 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.6 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 2.06 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.56 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.59 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.58 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.67 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 2.24 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.418 HG22 HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 1.35 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.569 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.91 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.92 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 2.11 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.569 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.87 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 1.39 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' A' ' 37' ' ' LYS . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 1.34 111.851 179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 2.06 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 1.5 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 1.51 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.36 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.98 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.439 ' O ' HG13 ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 2.28 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.62 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 1.03 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.529 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.34 109.464 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.62 ' HD2' ' O ' ' A' ' 49' ' ' PRO . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 5.46 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 1.18 112.566 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.611 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.65 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.78 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.415 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 1.44 111.129 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.46 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.66 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 5.25 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -63.83 103.45 0.57 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.34 111.234 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -75.92 124.82 27.97 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.76 -0.655 . . . . 4.14 110.262 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.808 -0.615 . . . . 7.41 110.17 179.359 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.285 -0.265 . . . . 7.3 110.285 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.41 ' NZ ' " H3'" ' C' ' 11' ' ' ' DG' . 15.2 tppt? -168.61 98.45 0.54 Allowed Pre-proline 0 CA--C 1.534 0.329 0 O-C-N 123.721 0.638 . . . . 6.75 110.026 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.485 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo -82.82 -73.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.055 1.837 . . . . 2.49 111.538 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 2.01 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 1.41 110.572 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 1.26 109.035 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 2.13 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.94 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.66 110.652 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 1.4 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.89 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 2.26 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 1.29 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 1.22 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.14 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.56 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.9 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 1.33 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.77 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.619 ' O ' HG13 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.25 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.441 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 2.4 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.46 HG13 ' HB2' ' B' ' 35' ' ' ARG . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.97 110.755 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.619 HG13 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.64 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.441 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.85 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.511 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.82 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.511 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.55 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.439 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.37 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . 0.411 ' HB2' ' O ' ' B' ' 28' ' ' SER . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 2.38 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.92 110.968 177.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.9 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.74 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.67 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.45 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.95 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.94 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 2.03 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.07 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 1.57 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 1.13 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.91 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.46 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 1.36 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.93 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.91 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.485 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 2.22 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.475 HD21 " H4'" ' C' ' 11' ' ' ' DG' . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.32 108.029 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.425 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.85 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.419 ' O ' HD13 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.83 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 1.26 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.426 ' HG2' " C5'" ' C' ' 13' ' ' ' DG' . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.57 111.949 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.415 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.03 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.419 HD13 ' O ' ' B' ' 52' ' ' CYS . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.79 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 1.3 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.26 28.81 4.72 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.09 113.997 -177.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' B' ' 59' ' ' LYS . 5.0 mtpt -97.61 47.59 1.02 Allowed 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 118.086 0.943 . . . . 6.26 109.481 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -112.49 86.32 2.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.572 -0.74 . . . . 5.54 109.447 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -32.1 42.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.977 -0.556 . . . . 6.13 110.176 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 mt . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.441 -0.799 . . . . 8.07 110.421 179.76 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.087 0 C3'-C2'-C1' 99.09 -2.579 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.533 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.217 0 C3'-C2'-C1' 99.365 -2.382 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.533 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.446 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.495 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.43 -2.335 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.495 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C3'-C2'-C1' 99.342 -2.399 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.453 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.076 0 C3'-C2'-C1' 99.613 -2.205 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.453 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.3 -2.429 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.449 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.449 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.066 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -1.418 0 C3'-C2'-C1' 99.676 -2.16 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C1'-C2' 103.983 -1.924 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.601 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.42 -1.258 0 C3'-C2'-C1' 99.889 -2.008 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.013 0 C3'-C2'-C1' 99.144 -2.54 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.426 " C5'" ' HG2' ' B' ' 54' ' ' GLN . . . . . . . . 0 O4'--C4' 1.455 0.842 0 C3'-C2'-C1' 99.638 -2.187 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.426 ' H72' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 99.047 -2.609 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.941 0 C3'-C2'-C1' 100.073 -1.876 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . 0.439 H2'' ' C6 ' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.627 -2.195 . . . . 1.63 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.439 ' C6 ' H2'' ' C' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 99.772 -2.091 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.38 -2.371 . . . . 1.1 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.026 -2.624 . . . . 1.2 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.421 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.153 0 C3'-C2'-C1' 99.803 -2.069 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.421 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 C3'-C2'-C1' 99.306 -2.424 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . 0.485 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 108.686 1.108 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.547 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 100.838 -1.33 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.547 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C4'-C3'-C2' 102.502 -0.698 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.471 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C4'-C3'-C2' 104.675 1.475 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.471 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 O4'-C1'-C2' 105.0 -1.0 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 104.263 1.117 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.51 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.687 0 O4'-C1'-C2' 107.24 1.036 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.579 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.949 0 C1'-O4'-C4' 107.044 -1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.787 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.859 0 C1'-O4'-C4' 106.989 -1.937 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.787 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.863 -0.598 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.564 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 100.273 -1.733 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.564 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C4'-C3'-C2' 104.304 1.104 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.415 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.424 -0.982 0 C3'-C2'-C1' 104.905 1.575 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.529 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.542 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 C3'-C2'-C1' 101.093 -1.148 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.542 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.657 0 O4'-C1'-C2' 105.131 -0.881 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.49 ' C2 ' ' C2 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C2'-C3'-O3' 113.03 0.9 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.49 ' C2 ' ' C2 ' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 N19-C1'-C2' 115.982 1.114 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.453 ' N7 ' ' C2 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.913 0 O4'-C1'-N19 108.668 1.085 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.463 ' C2 ' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C1'-C2' 104.936 -1.058 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.463 ' C6 ' ' C2 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 C4'-C3'-C2' 104.154 0.954 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.522 H2'' ' C5 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C3'-C2'-C1' 101.055 -1.175 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.522 ' C5 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 C3'-C2'-C1' 101.714 -0.704 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.655 0.264 . . . . 6.16 110.469 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.55 116.86 63.0 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.846 -0.428 . . . . 5.73 109.846 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.81 114.92 2.36 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.731 1.621 . . . . 3.0 111.248 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.54 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 1.28 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.59 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 1.67 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 2.35 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.67 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 1.28 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' A' ' 6' ' ' LEU . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 1.32 111.71 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.4 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 2.19 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 1.21 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.37 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 1.38 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.33 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.59 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 2.05 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 5.6 tp-100 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 2.09 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 1.32 112.142 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.99 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.08 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' NH2' ' N7 ' ' C' ' 5' ' ' ' DG' . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 3.11 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 2.18 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.96 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.61 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.81 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.6 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 2.06 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.56 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.59 111.029 -178.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.58 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.67 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 2.24 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.428 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 1.35 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.425 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.91 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.92 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 34' ' ' THR . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 2.11 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.87 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 1.39 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 1.34 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.432 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 2.06 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 1.5 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.445 ' O ' HG23 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 1.51 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.36 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.432 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.98 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 2.28 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 1.03 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.54 HD21 " C5'" ' D' ' 12' ' ' ' DG' . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.34 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 5.46 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.474 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.42 ' HB2' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 1.18 111.132 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.471 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.65 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.62 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 27.9 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.78 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 1.44 111.762 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.46 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.66 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.62 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 5.25 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.416 ' HB3' ' HB3' ' B' ' 2' ' ' LYS . 23.4 mp0 -56.83 -34.03 67.34 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.34 111.548 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.403 ' HA ' ' HD3' ' B' ' 2' ' ' LYS . 73.9 m -85.14 34.49 0.56 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.805 -0.634 . . . . 4.14 110.923 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.3 tp . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.232 -0.89 . . . . 7.41 109.536 -179.602 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.776 0.322 . . . . 7.3 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.416 ' HB3' ' HB3' ' A' ' 60' ' ' GLN . 2.1 pttm -153.51 70.8 6.76 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.293 -0.412 . . . . 6.75 110.751 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -92.18 -151.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.832 2.355 . . . . 2.49 112.732 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 2.01 108.609 178.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.506 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 1.41 111.593 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 1.26 108.366 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.503 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 2.13 109.501 177.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.94 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.409 HG21 ' O ' ' B' ' 5' ' ' THR . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.66 109.956 178.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 1.4 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.89 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 2.26 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 1.29 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 1.22 109.648 179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.14 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.56 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.9 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' THR . . . . . 0.408 HG21 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 1.33 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.562 ' O ' HG11 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.77 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.25 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.412 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 2.4 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.562 HG11 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.97 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.64 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.412 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.85 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.82 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.55 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.37 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 45.4 m80 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 2.38 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.92 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.9 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.74 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.67 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.45 110.367 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.95 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.94 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 2.03 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.07 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 1.57 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 1.13 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.91 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.46 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 1.36 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.93 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.91 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 2.22 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.698 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.32 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.85 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.502 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.83 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 1.26 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.698 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.57 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 0.3 OUTLIER -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.03 111.676 -178.405 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.405 HD13 ' O ' ' B' ' 52' ' ' CYS . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.79 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 1.3 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 119.48 15.92 5.28 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.09 113.469 178.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.505 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 22.9 mttp -104.91 86.68 2.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.295 -1.002 . . . . 6.26 108.295 179.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -153.7 128.91 9.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.262 -0.881 . . . . 5.54 110.922 -176.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.47 -18.53 44.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 6.13 111.575 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 68.6 mt . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.629 -0.714 . . . . 8.07 111.536 179.423 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.03 0 C3'-C2'-C1' 99.33 -2.407 . . . . 2.54 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.565 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 C3'-C2'-C1' 99.399 -2.358 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-C2' 103.685 -2.196 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.508 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.366 -2.382 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.508 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.929 0 C3'-C2'-C1' 98.908 -2.708 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.491 ' N7 ' ' NH2' ' A' ' 22' ' ' ARG . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 O4'-C1'-C2' 104.027 -1.884 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.488 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.869 -2.022 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 C3'-C2'-C1' 99.262 -2.456 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 100.12 -1.843 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.489 ' C8 ' ' N7 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.942 -1.97 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.506 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.291 0 C3'-C2'-C1' 98.266 -3.167 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 99.781 -2.085 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.039 0 C3'-C2'-C1' 98.774 -2.804 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.425 ' OP2' " H2'" ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.801 0 C3'-C2'-C1' 99.505 -2.282 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 C3'-C2'-C1' 100.042 -1.899 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.5 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.947 0 C3'-C2'-C1' 99.661 -2.171 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.931 0 C3'-C2'-C1' 98.959 -2.672 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.6 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.945 0 C3'-C2'-C1' 99.294 -2.433 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.6 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.82 0 C3'-C2'-C1' 99.353 -2.39 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 98.866 -2.738 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.277 -2.445 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.923 -1.269 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.606 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 100.272 -1.734 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.606 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.676 0.697 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.483 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.657 0 C3'-C2'-C1' 105.403 1.931 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.483 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 P--O3' 1.623 1.306 0 C4'-C3'-C2' 104.416 1.216 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O4'-C1'-C2' 106.665 0.514 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 N19-C1'-C2' 115.818 1.011 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.924 0 C3'-C2'-C1' 104.848 1.534 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.523 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 105.238 1.813 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.523 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 108.294 0.618 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.512 H2'' " O5'" ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 N19-C1'-C2' 116.1 1.188 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.512 " O5'" H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.528 -0.837 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.54 " C5'" HD21 ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.405 -1.116 0 C1'-O4'-C4' 107.737 -1.402 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.426 ' C4 ' ' C5 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.851 0 C1'-O4'-C4' 107.221 -1.771 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.505 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C4'-C3'-C2' 104.624 1.424 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.505 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.441 0.75 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.568 " H4'" " C5'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.22 0 C3'-C2'-C1' 104.999 1.642 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.568 " C5'" " H4'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.624 1.382 0 C5'-C4'-C3' 116.806 1.404 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C5'-C4'-O4' 108.116 -0.803 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 N19-C1'-C2' 116.239 1.275 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 103.966 0.766 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.433 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 N19-C1'-C2' 115.25 0.656 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.433 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 101.473 -0.876 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.6 mmt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.207 -0.294 . . . . 6.16 110.207 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -97.25 112.46 61.0 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.39 -0.368 . . . . 5.73 110.674 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -67.25 102.37 0.68 Allowed 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 122.334 2.023 . . . . 3.0 111.934 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.54 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 1.28 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.578 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 1.67 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 2.35 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.67 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 1.28 109.13 177.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 1.32 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.4 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 2.19 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 1.21 111.945 -178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.37 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 1.38 110.047 -179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.33 110.499 178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.427 ' HB2' HD23 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 2.05 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 2.09 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.438 ' O ' HG21 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 1.32 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.99 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.08 110.593 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.421 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 3.11 110.328 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.438 HG21 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 2.18 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.96 111.044 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.61 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 26' ' ' GLN . 2.2 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.81 112.647 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.6 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 2.06 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.424 ' O ' HG21 ' A' ' 30' ' ' VAL . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.56 110.044 179.088 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 29' ' ' HIS . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.59 109.813 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.511 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.58 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.67 112.162 -178.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 2.24 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.523 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 1.35 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 35' ' ' ARG . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.91 110.757 179.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.92 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 2.11 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.87 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 1.39 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 1.34 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 2.06 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 1.5 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 1.51 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.36 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.98 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 2.28 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 1.03 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.447 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.34 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 5.46 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.447 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.541 ' CA ' HD13 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 1.18 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.65 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.497 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.78 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.435 HD22 ' N2 ' ' D' ' 12' ' ' ' DG' . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 1.44 109.487 -179.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.46 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.66 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 5.25 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.497 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 -73.46 -67.17 0.61 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.34 108.701 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.4 m -146.86 16.66 1.24 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.255 -1.016 . . . . 4.14 108.255 178.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 49.0 tp . . . . . 0 C--O 1.239 0.511 0 CA-C-N 115.389 -0.823 . . . . 7.41 111.048 179.809 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.597 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 65.0 mtt . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 109.769 -0.456 . . . . 7.3 109.769 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -103.62 94.87 6.56 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.743 -0.466 . . . . 6.75 109.743 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.597 ' HD3' ' O ' ' B' ' 1' ' ' MET . 56.5 Cg_endo -100.2 132.72 0.18 Allowed 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 123.276 2.651 . . . . 2.49 113.032 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 2.01 109.209 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.401 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 1.41 111.399 -178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.419 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 1.26 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 2.13 108.546 177.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.94 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.66 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 1.4 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.89 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.418 ' HB2' HD13 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 2.26 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 1.29 111.433 -178.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 1.22 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.14 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.419 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.56 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.9 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 1.33 111.072 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.77 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.25 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 2.4 111.802 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.97 109.32 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.64 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.85 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.82 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.55 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.37 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.0 m80 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 2.38 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.92 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.9 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.74 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.534 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.67 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.45 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.95 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.94 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.449 HG23 ' N ' ' B' ' 39' ' ' GLU . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 2.03 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.449 ' N ' HG23 ' B' ' 38' ' ' VAL . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.07 110.202 -179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 1.57 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 1.13 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' MET . . . . . 0.452 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.91 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . 0.452 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.46 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 1.36 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.93 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.91 110.65 178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 2.22 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.554 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.32 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.429 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.85 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.554 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.83 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . 0.43 ' HB2' " H5'" ' C' ' 12' ' ' ' DA' . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 1.26 110.711 179.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.57 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.03 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.541 HD13 ' CA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.79 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 1.3 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 131.56 25.97 0.75 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.09 114.379 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.527 ' HZ1' " H4'" ' C' ' 13' ' ' ' DG' . 6.2 mttt -125.54 96.25 4.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 117.906 0.853 . . . . 6.26 109.92 179.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 -72.29 107.6 4.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.167 -0.924 . . . . 5.54 110.807 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.95 -51.54 4.21 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.517 -0.765 . . . . 6.13 112.077 -178.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 1.4 mm? . . . . . 0 C--O 1.252 1.23 0 O-C-N 124.105 0.878 . . . . 8.07 109.634 -177.786 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.427 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.746 0 C3'-C2'-C1' 99.5 -2.286 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.525 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.451 0 O4'-C1'-C2' 103.695 -2.186 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.525 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.716 0 O4'-C1'-C2' 103.544 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.497 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C1'-C2' 103.763 -2.125 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.497 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.419 -1.283 0 C3'-C2'-C1' 98.968 -2.665 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.417 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 100.127 -1.838 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.479 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 C3'-C2'-C1' 99.607 -2.209 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.479 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.312 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.105 0 O4'-C1'-C2' 103.905 -1.995 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.507 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.424 0 C3'-C2'-C1' 98.798 -2.787 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.507 ' C4 ' ' C4 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.064 0 C3'-C2'-C1' 99.363 -2.384 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.504 ' N2 ' ' HB3' ' B' ' 56' ' ' LEU . . . . . . . . 0 P--O3' 1.616 0.729 0 C3'-C2'-C1' 99.454 -2.319 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.454 ' C6 ' ' C6 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.275 0 C3'-C2'-C1' 98.505 -2.996 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.527 " H4'" ' HZ1' ' B' ' 59' ' ' LYS . . . . . . . . 0 O4'--C4' 1.452 0.57 0 C3'-C2'-C1' 99.877 -2.016 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.325 -2.411 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.872 -2.026 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.218 -2.487 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.494 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.986 0 C3'-C2'-C1' 99.858 -2.03 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.494 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 98.747 -2.823 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.446 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C3'-C2'-C1' 99.509 -2.279 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.431 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.822 0 O4'-C1'-C2' 103.661 -2.217 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.431 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.37 -2.378 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.353 0 C3'-C2'-C1' 99.198 -2.501 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 N19-C1'-C2' 116.036 1.147 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.79 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 C3'-C2'-C1' 99.608 -2.209 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.79 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.657 1.398 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.537 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.79 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.537 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C4'-C3' 106.435 0.835 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.557 " H1'" " H5'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-C2' 107.078 0.89 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.627 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.938 0 C3'-C2'-C1' 104.842 1.53 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.627 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.529 1.053 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 C1'-O4'-C4' 107.499 -1.572 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.462 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.897 0 C4'-C3'-C2' 104.471 1.271 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.462 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.444 1.027 0 C3'-C2'-C1' 105.922 2.301 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.622 1.252 0 P-O3'-C3' 120.966 1.055 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.435 ' N2 ' HD22 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.424 -1.018 0 C3'-C2'-C1' 105.026 1.662 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.584 " H2'" ' C6 ' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.596 -0.913 0 C1'-O4'-C4' 106.707 -2.138 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.584 ' C6 ' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.592 1.392 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.574 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 104.685 1.418 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.501 ' C8 ' " C2'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 101.181 -1.085 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.494 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.68 -2.157 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.494 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 C5'-C4'-O4' 108.253 -0.717 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.435 ' H72' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-C2' 104.623 -1.342 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.216 1.016 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.557 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 P-O5'-C5' 119.825 -0.672 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.557 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.827 0 N19-C1'-C2' 115.437 0.773 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.612 0.244 . . . . 6.16 111.108 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.467 ' HB3' HG22 ' A' ' 4' ' ' VAL . 23.6 mmtt -140.07 135.69 16.54 Favored Pre-proline 0 C--O 1.235 0.304 0 N-CA-C 109.721 -0.474 . . . . 5.73 109.721 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -84.63 47.51 2.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.829 2.353 . . . . 3.0 112.073 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.467 HG22 ' HB3' ' A' ' 2' ' ' LYS . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.54 108.632 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' HG21 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 1.28 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.454 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 1.67 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 2.35 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.67 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 1.28 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 1.32 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.4 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 2.19 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.37 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 1.38 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.33 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.454 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 2.05 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 2.09 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 1.32 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.651 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.99 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.455 ' H ' HG21 ' A' ' 20' ' ' VAL . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.08 113.321 -178.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 3.11 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 2.18 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.96 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.521 HD22 ' P ' ' D' ' 14' ' ' ' DT' . 50.7 m-80 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.61 113.037 -178.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HB2' ' H ' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.81 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.471 ' H ' ' HB2' ' A' ' 26' ' ' GLN . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.6 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 2.06 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.56 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.442 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.59 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.58 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.67 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 2.24 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 1.35 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.91 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.92 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 2.11 112.175 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.87 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 1.39 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 1.34 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.6 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 2.06 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 1.5 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 1.51 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.36 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.98 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 2.28 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.539 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 1.03 111.905 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.446 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.34 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.554 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 5.46 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 1.18 112.257 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.554 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.65 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.78 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.62 ' HA ' ' OE1' ' A' ' 60' ' ' GLN . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 1.44 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.46 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.66 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 5.25 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER 49.83 37.56 13.71 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.34 112.893 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 m -87.99 75.44 8.76 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.379 0.511 . . . . 4.14 112.379 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 7.41 109.652 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.413 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 89.2 mmm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.872 0.368 . . . . 7.3 110.239 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -97.77 103.94 19.18 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.101 -0.499 . . . . 6.75 109.912 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' B' ' 1' ' ' MET . 73.7 Cg_endo -94.49 90.69 0.12 Allowed 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.188 1.925 . . . . 2.49 112.154 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 2.01 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.427 ' HA ' ' OP2' ' C' ' 12' ' ' ' DA' . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 1.41 111.699 -177.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 1.26 108.695 177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 2.13 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.94 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.425 HG12 ' HB2' ' B' ' 41' ' ' ALA . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.66 110.632 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . 0.419 ' HA ' HG22 ' B' ' 20' ' ' VAL . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 1.4 111.625 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.89 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 2.26 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 1.29 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.403 HG21 HG21 ' B' ' 20' ' ' VAL . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 1.22 110.331 -179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.14 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.56 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.542 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.9 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 1.33 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' B' ' 10' ' ' ALA . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.77 111.179 178.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.25 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 2.4 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . 0.452 HG21 ' CG1' ' B' ' 30' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.97 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.64 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.85 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.82 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.55 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.37 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 2.38 109.744 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.452 ' CG1' HG21 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.92 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.9 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . 0.667 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.74 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . 0.489 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.67 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.45 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.667 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.95 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.489 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.94 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 2.03 112.14 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.07 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 1.57 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.425 ' HB2' HG12 ' B' ' 9' ' ' VAL . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 1.13 110.476 178.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' MET . . . . . 0.441 ' HE2' ' HA ' ' B' ' 39' ' ' GLU . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.91 110.554 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.46 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 1.36 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.93 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.91 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 2.22 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.469 HD21 " H4'" ' C' ' 11' ' ' ' DG' . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.32 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.85 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.408 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.83 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 1.26 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.57 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.03 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.419 HD12 HD21 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.79 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 1.3 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 63.33 0.26 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.09 112.715 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -84.13 68.05 9.95 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.415 -0.462 . . . . 6.26 111.004 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -94.05 121.67 35.77 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.193 -0.603 . . . . 5.54 109.984 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.38 -30.09 60.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.071 -0.513 . . . . 6.13 110.82 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.483 -0.77 . . . . 8.07 110.098 -179.681 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.529 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.885 0 C3'-C2'-C1' 99.573 -2.233 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.529 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.5 -1.503 0 C3'-C2'-C1' 99.593 -2.219 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.474 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C1'-C2' 103.757 -2.13 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.429 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.248 0 C3'-C2'-C1' 99.389 -2.365 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.429 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.153 -2.534 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.516 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 O4'-C1'-C2' 103.686 -2.194 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.516 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.871 0 C3'-C2'-C1' 99.644 -2.183 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.4 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.883 -2.012 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.417 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 C3'-C2'-C1' 99.558 -2.244 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.417 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-C2' 103.874 -2.024 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.481 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.059 0 C3'-C2'-C1' 100.194 -1.79 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.481 ' C8 ' H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -0.981 0 C3'-C2'-C1' 99.376 -2.374 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.427 ' OP2' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.506 -1.068 0 C3'-C2'-C1' 99.228 -2.48 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.897 0 C3'-C2'-C1' 100.066 -1.881 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.479 -2.301 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . 0.542 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.507 -0.967 0 C3'-C2'-C1' 99.148 -2.537 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.264 0 C3'-C2'-C1' 99.699 -2.144 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 99.692 -2.148 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.543 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.847 0 C3'-C2'-C1' 99.73 -2.122 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.543 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 99.304 -2.425 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.822 0 C3'-C2'-C1' 99.682 -2.155 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.772 0 C3'-C2'-C1' 99.544 -2.254 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C3'-C2'-C1' 99.027 -2.623 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C1'-O4'-C4' 110.517 0.584 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 N19-C1'-C2' 115.822 1.014 . . . . 2.52 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.461 H2'' ' H72' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.173 -1.09 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.557 " H2'" ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 C3'-C2'-C1' 105.294 1.853 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.557 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 N19-C1'-C2' 114.889 0.43 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.512 -0.559 0 O4'-C4'-C3' 104.35 -1.25 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.786 -1.367 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.753 0 C4'-C3'-C2' 104.623 1.423 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 105.407 1.933 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.439 -2.33 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.422 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 N19-C1'-C2' 116.335 1.335 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.422 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.497 0.57 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.581 H2'' " O5'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.531 1.328 0 C1'-O4'-C4' 106.486 -2.296 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.581 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 107.086 -1.867 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.521 ' P ' HD22 ' A' ' 25' ' ' ASN . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 C3'-C2'-C1' 100.961 -1.242 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.427 ' OP2' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.497 0 C3'-C2'-C1' 100.622 -1.485 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-N19 108.427 0.784 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.636 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.436 -2.331 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.636 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.94 0 N19-C1'-C2' 113.219 -0.613 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 C3'-C2'-C1' 100.837 -1.331 . . . . 1.44 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.403 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C5'-C4'-O4' 107.95 -0.906 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.403 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 100.59 -1.507 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.759 0 O4'-C1'-C2' 105.052 -0.953 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.481 1.122 0 CA-C-O 121.107 0.479 . . . . 6.16 110.049 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -101.22 142.26 24.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.971 -0.559 . . . . 5.73 109.902 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.19 68.55 7.86 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.96 1.773 . . . . 3.0 112.05 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.542 HG22 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.54 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.493 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 1.28 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 1.67 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 2.35 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.484 ' HB2' HG12 ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.67 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 1.28 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 1.32 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.4 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 2.19 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 1.21 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.37 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 1.38 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.33 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 2.05 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 2.09 110.687 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 1.32 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.99 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.414 ' N ' HG21 ' A' ' 20' ' ' VAL . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.08 111.974 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 3.11 111.023 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 2.18 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.96 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.61 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.81 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.6 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 2.06 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.56 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.59 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.58 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.67 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 2.24 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 1.35 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.592 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.91 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.92 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 2.11 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.592 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.87 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 1.39 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 1.34 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 2.06 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 1.5 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.542 ' HB3' HG22 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 1.51 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.36 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.98 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 2.28 109.994 178.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.566 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 1.03 112.606 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.55 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.34 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.405 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 5.46 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 1.18 109.762 178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.65 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 62' ' ' LEU . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.78 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.452 HD23 HD12 ' B' ' 56' ' ' LEU . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 1.44 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.46 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.66 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 5.25 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER 73.69 17.08 3.73 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.34 110.977 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.59 -43.61 3.63 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 108.909 -0.774 . . . . 4.14 108.909 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.561 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.359 -1.305 . . . . 7.41 109.038 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.904 0.383 . . . . 7.3 111.046 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.477 ' O ' HG11 ' B' ' 4' ' ' VAL . 40.1 tttm -136.14 115.62 11.05 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.247 -0.433 . . . . 6.75 109.9 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.18 90.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.843 2.362 . . . . 2.49 111.688 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . 0.477 HG11 ' O ' ' B' ' 2' ' ' LYS . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 2.01 111.442 -178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.584 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 1.41 110.236 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . 0.449 HD21 ' HA ' ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 1.26 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 2.13 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.94 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . 0.403 ' CG2' ' HB2' ' B' ' 47' ' ' TYR . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.66 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 1.4 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.89 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . 0.414 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 2.26 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 1.29 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 1.22 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.14 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . 0.409 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.56 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.9 111.828 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 1.33 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.409 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.77 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.25 110.619 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.515 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 2.4 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.97 110.183 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.64 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.85 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.82 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.55 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.515 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.37 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 52.5 m80 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 2.38 115.364 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.92 111.315 176.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.9 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.74 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.67 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.45 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.488 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.95 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.94 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 2.03 111.231 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.07 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 1.57 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 1.13 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.91 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.46 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 1.36 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . 0.413 ' HB3' ' H ' ' B' ' 2' ' ' LYS . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.93 112.02 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . 0.403 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.91 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 2.22 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.495 ' HB3' " C5'" ' C' ' 12' ' ' ' DA' . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.32 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . 0.57 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.85 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.83 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 1.26 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.57 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.57 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.03 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.79 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 1.3 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 177.17 49.06 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.09 112.445 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.453 ' HG2' ' OE1' ' B' ' 60' ' ' GLN . 12.5 pttm -45.0 -22.55 0.09 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.505 0.928 . . . . 6.26 113.505 177.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.453 ' OE1' ' HG2' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -76.01 4.99 7.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.241 0.544 . . . . 5.54 111.316 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m -91.97 120.85 33.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.194 0.521 . . . . 6.13 109.661 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 C--O 1.247 0.962 0 CA-C-N 114.747 -1.115 . . . . 8.07 111.41 179.973 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.401 " H2'" HO5' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.961 0 C3'-C2'-C1' 99.307 -2.423 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.324 0 C3'-C2'-C1' 99.596 -2.217 . . . . 2.12 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.673 0 O4'-C1'-C2' 103.752 -2.135 . . . . 1.52 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.623 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.458 1.099 0 C3'-C2'-C1' 99.731 -2.12 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.623 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 99.227 -2.481 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.572 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.448 -2.323 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.572 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-C2' 103.613 -2.261 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.899 0 C3'-C2'-C1' 99.572 -2.234 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.483 -2.298 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.359 0 O4'-C1'-C2' 103.889 -2.01 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.885 0 O4'-C1'-C2' 103.729 -2.156 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.531 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 99.527 -2.266 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.584 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.152 0 C3'-C2'-C1' 99.24 -2.472 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.438 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 C3'-C2'-C1' 99.651 -2.178 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.438 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 99.405 -2.354 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.055 0 C3'-C2'-C1' 99.372 -2.377 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 99.471 -2.306 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . 0.534 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.847 0 C3'-C2'-C1' 99.478 -2.301 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.534 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.087 0 C3'-C2'-C1' 99.075 -2.589 . . . . 1.2 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.457 0.997 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . 0.432 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.416 -2.346 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . 0.432 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.362 -2.384 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 N19-C1'-C2' 116.043 1.152 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.505 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C3'-C2'-C1' 100.212 -1.777 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.505 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 110.644 0.674 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.553 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.696 0 C3'-C2'-C1' 105.251 1.822 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.553 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-C2' 105.025 -0.977 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . 0.419 H2'' ' OP2' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.048 0 C3'-C2'-C1' 104.136 1.026 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . 0.499 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 N19-C1'-C2' 116.297 1.31 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . 0.499 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 105.355 1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C4'-C3'-C2' 104.608 1.408 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.402 ' C6 ' ' C7 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 100.567 -1.523 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.503 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.139 -2.544 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.503 ' C5 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 C3'-C2'-C1' 101.701 -0.714 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.729 H2'' " O5'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.53 1.211 0 C1'-O4'-C4' 105.863 -2.741 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.729 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.527 0.93 0 C3'-C2'-C1' 105.22 1.8 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.451 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.749 0 O4'-C1'-C2' 104.617 -1.348 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . 0.451 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 O4'-C4'-C3' 106.523 0.923 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.564 0 C3'-C2'-C1' 100.531 -1.55 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.415 H2'' ' H8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.753 0 O4'-C1'-C2' 104.816 -1.167 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.415 ' H8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.833 0 C1'-O4'-C4' 110.298 0.427 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.515 ' C6 ' ' H73' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C4'-C3'-C2' 104.035 0.835 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.522 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C4'-C3'-C2' 104.329 1.129 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.522 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 100.549 -1.536 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . 0.517 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.571 1.371 . . . . 2.51 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tmm? . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.974 -0.38 . . . . 6.16 109.974 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 4' ' ' VAL . 32.8 ttpt -117.02 136.78 23.39 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.753 -0.462 . . . . 5.73 109.753 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -65.97 75.39 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.017 2.478 . . . . 3.0 112.765 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 2' ' ' LYS . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.54 108.898 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 1.28 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 1.67 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 2.35 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.67 109.98 -179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 1.28 110.774 179.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.464 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 1.32 110.913 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.4 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 2.19 110.165 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.568 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 1.21 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.37 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 1.38 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.464 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.33 109.753 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.421 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 2.05 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 2.09 110.182 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 1.32 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.99 110.564 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.08 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.512 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 3.11 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 2.18 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.96 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.61 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.81 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.6 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 2.06 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.56 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.59 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.58 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.67 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 2.24 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 1.35 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.91 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.92 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 2.11 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.477 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.87 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 1.39 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 37' ' ' LYS . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 1.34 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 2.06 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 1.5 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 1.51 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.36 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.98 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 2.28 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 1.03 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.34 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 5.46 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.432 ' HB3' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 1.18 109.619 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.45 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.65 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.78 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.438 ' C ' ' H ' ' A' ' 58' ' ' GLY . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 1.44 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.46 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.438 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.66 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.633 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 5.25 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.485 HE22 " C5'" ' C' ' 11' ' ' ' DG' . 5.0 mt-30 -79.07 126.91 31.33 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.34 110.448 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 98.1 11.57 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.023 -0.535 . . . . 4.14 109.886 179.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.259 -0.877 . . . . 7.41 110.743 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 ttt . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.026 -0.361 . . . . 7.3 110.026 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' LYS . . . . . 0.44 ' O ' ' HG2' ' B' ' 2' ' ' LYS . 0.0 OUTLIER -106.02 132.93 20.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.888 0.375 . . . . 6.75 110.177 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -83.9 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.497 2.131 . . . . 2.49 113.099 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 2.01 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' THR . . . . . 0.545 ' HG1' ' HB2' ' B' ' 7' ' ' TYR . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 1.41 110.394 -177.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 1.26 108.956 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' TYR . . . . . 0.545 ' HB2' ' HG1' ' B' ' 5' ' ' THR . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 2.13 109.689 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.94 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.66 111.698 -179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 1.4 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.89 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 2.26 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 1.29 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 1.22 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' SER . . . . . 0.458 ' O ' HG22 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.14 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.56 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.9 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 1.33 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.77 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.25 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 2.4 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.97 109.961 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.64 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . 0.453 ' OD1' ' HB3' ' B' ' 27' ' ' ALA . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.85 110.993 -179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.82 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' ALA . . . . . 0.453 ' HB3' ' OD1' ' B' ' 25' ' ' ASN . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.55 113.117 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.37 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 2.38 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.92 109.849 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.9 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.74 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.67 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.45 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.95 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.94 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 2.03 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.07 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 1.57 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 1.13 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.91 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.46 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 1.36 112.021 -178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 32.4 t30 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.93 110.76 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.91 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 2.22 107.421 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' B' ' 54' ' ' GLN . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.32 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.85 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' CYS . . . . . 0.458 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.83 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 1.26 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.57 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.408 ' HA ' ' HB2' ' B' ' 59' ' ' LYS . 0.1 OUTLIER -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.03 110.695 -179.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.79 109.753 179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 1.3 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 107.1 107.81 3.23 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.09 111.167 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 54' ' ' GLN . 7.5 mtpp -131.85 9.0 4.52 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.077 0.465 . . . . 6.26 110.049 179.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -118.61 118.79 32.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.779 -0.646 . . . . 5.54 109.516 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.4 m -82.26 2.02 33.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.536 -0.302 . . . . 6.13 111.337 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 C--O 1.245 0.835 0 O-C-N 123.784 0.678 . . . . 8.07 110.44 -179.605 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' -1' ' ' ' DG' . . . . . 0.562 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 99.387 -2.367 . . . . 2.54 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 1' ' ' ' DA' . . . . . 0.562 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 C3'-C2'-C1' 99.176 -2.517 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 2' ' ' ' DA' . . . . . 0.497 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.723 0 C3'-C2'-C1' 99.851 -2.035 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 3' ' ' ' DA' . . . . . 0.496 ' C8 ' ' H73' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.069 0 C3'-C2'-C1' 99.095 -2.575 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 4' ' ' ' DT' . . . . . 0.496 ' H73' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.601 0 C3'-C2'-C1' 98.683 -2.869 . . . . 1.37 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 5' ' ' ' DG' . . . . . 0.501 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.864 0 C3'-C2'-C1' 99.634 -2.19 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 6' ' ' ' DT' . . . . . 0.501 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.848 0 C3'-C2'-C1' 99.457 -2.316 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.412 ' N7 ' ' OH ' ' A' ' 17' ' ' TYR . . . . . . . . 0 C2'--C1' 1.504 -1.189 0 C3'-C2'-C1' 99.212 -2.491 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 8' ' ' ' DA' . . . . . 0.573 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.731 0 C3'-C2'-C1' 99.511 -2.278 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 9' ' ' ' DG' . . . . . 0.573 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.355 0 C3'-C2'-C1' 99.718 -2.13 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 10' ' ' ' DC' . . . . . 0.422 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.1 0 C3'-C2'-C1' 99.736 -2.117 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 11' ' ' ' DG' . . . . . 0.508 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.957 0 C3'-C2'-C1' 99.752 -2.105 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 12' ' ' ' DA' . . . . . 0.508 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 98.868 -2.737 . . . . 0.75 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.997 -1.931 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.083 0 C3'-C2'-C1' 98.794 -2.79 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 O4'-C1'-C2' 103.945 -1.959 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 99.559 -2.243 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . 0.503 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.31 -2.422 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 C3'-C2'-C1' 99.626 -2.196 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.07 0 C3'-C2'-C1' 99.977 -1.945 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.527 -2.266 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 99.368 -2.38 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 C4'-C3'-C2' 104.162 0.962 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 1' ' ' ' DG' . . . . . 0.583 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 100.945 -1.253 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 2' ' ' ' DG' . . . . . 0.583 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C4'-C3'-C2' 101.861 -1.339 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 3' ' ' ' DT' . . . . . 0.415 H2'' ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.971 -1.235 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 4' ' ' ' DT' . . . . . 0.415 ' C5 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C4'-C3'-C2' 104.239 1.039 . . . . 1.38 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C1'-O4'-C4' 110.489 0.563 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C4'-C3'-C2' 102.4 -0.8 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.745 1.545 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 8' ' ' ' DA' . . . . . 0.639 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 105.233 1.809 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 9' ' ' ' DC' . . . . . 0.639 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C5'-C4'-C3' 113.586 -0.743 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 10' ' ' ' DT' . . . . . 0.524 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.728 -2.123 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 11' ' ' ' DC' . . . . . 0.524 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C1'-O4'-C4' 110.553 0.609 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 12' ' ' ' DG' . . . . . 0.432 ' N3 ' ' HB3' ' A' ' 53' ' ' ALA . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C4'-C3'-C2' 104.423 1.223 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 13' ' ' ' DC' . . . . . 0.427 " H2'" ' C6 ' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.741 0 C1'-O4'-C4' 106.626 -2.196 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 14' ' ' ' DT' . . . . . 0.427 ' C6 ' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 104.846 -1.14 . . . . 1.15 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C5'-C4'-C3' 115.667 0.645 . . . . 1.17 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' D' D ' 16' ' ' ' DA' . . . . . 0.545 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-C2' 105.079 -0.928 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 17' ' ' ' DC' . . . . . 0.581 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.342 -0.689 . . . . 1.57 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 18' ' ' ' DA' . . . . . 0.581 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-C2' 107.454 1.231 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 19' ' ' ' DT' . . . . . 0.489 " O4'" " H1'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.614 1.414 . . . . 1.44 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 20' ' ' ' DT' . . . . . 0.476 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.768 -0.666 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 21' ' ' ' DT' . . . . . 0.476 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 N19-C1'-C2' 116.231 1.269 . . . . 2.18 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.421 -0.781 0 C4'-C3'-C2' 104.382 1.182 . . . . 2.51 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo . . . . . 0 N--CA 1.455 -0.794 0 N-CA-C 110.2 -0.731 . . . . 2.43 110.2 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.03 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 0.76 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.459 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 0.99 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 1.51 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.67 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 0.71 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.445 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 0.68 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.4 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 1.47 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 0.77 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.37 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 0.77 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.33 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 1.32 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 1.44 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 0.77 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.71 HG12 HG13 ' A' ' 38' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.38 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.08 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 2.55 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 1.63 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.38 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.61 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.7 110.148 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.415 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.1 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.98 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.38 110.023 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.11 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.32 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.13 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 1.75 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 0.99 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.34 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.45 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.71 HG13 HG12 ' A' ' 20' ' ' VAL . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 1.45 112.084 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.87 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 0.88 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 0.71 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 1.47 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 0.93 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 0.99 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.2 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.23 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 1.88 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 0.84 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.581 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.1 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 4.72 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.524 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 0.66 111.112 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.46 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.602 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.45 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.639 HD22 HD13 ' B' ' 56' ' ' LEU . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 0.78 111.575 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.08 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.66 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 4.79 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.602 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 6.2 mp0 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.34 110.239 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo . . . . . 0 CA--C 1.529 0.271 0 CA-C-O 120.903 0.293 . . . . 2.1 112.116 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 1.43 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 8' ' ' ASP . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 0.81 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 0.61 109.175 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 1.32 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.94 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' B' ' 41' ' ' ALA . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.14 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.72 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.89 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.412 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 1.46 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 0.67 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 0.72 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.1 110.594 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.49 111.03 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.43 111.343 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 0.78 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.08 111.466 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.12 109.982 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.558 ' HB3' HG22 ' B' ' 30' ' ' VAL . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 1.88 110.573 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.459 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.39 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.31 110.22 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.19 110.758 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.3 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.08 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.25 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 1.75 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.558 HG22 ' HB3' ' B' ' 22' ' ' ARG . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.35 111.857 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.58 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.694 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.27 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.2 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.05 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.694 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.54 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.5 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' B' ' 23' ' ' VAL . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 1.38 113.948 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.07 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 0.91 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.554 ' HB3' HG13 ' B' ' 9' ' ' VAL . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 0.73 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.4 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.03 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 0.84 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.56 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.471 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.88 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 1.6 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.09 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.39 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.83 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 0.63 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.33 111.143 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.449 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.3 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.03 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 56' ' ' LEU . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.21 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 0.99 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.09 113.382 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.458 -0.574 0 N-CA-C 113.772 0.643 . . . . 2.43 113.772 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.03 109.766 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 0.76 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.603 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 0.99 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 1.51 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.67 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 0.71 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 0.68 111.164 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.4 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 1.47 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 0.77 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.37 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 0.77 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.424 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.33 109.876 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.603 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 1.32 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 1.44 111.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 0.77 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.416 HG12 ' HB ' ' A' ' 38' ' ' VAL . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.38 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.08 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 2.55 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 35' ' ' ARG . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 1.63 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.38 109.329 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.61 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.7 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.486 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.1 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 1.98 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.38 111.029 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.11 112.795 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.32 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.13 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 1.75 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 0.99 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.618 ' HA ' HG21 ' A' ' 23' ' ' VAL . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.34 109.601 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.45 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 20' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 1.45 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.87 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 0.88 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.71 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 1.47 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 0.93 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 0.99 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.2 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.23 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 1.88 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 0.84 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.1 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 4.72 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 0.66 113.039 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.46 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.45 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.92 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 0.78 112.412 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.08 113.241 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.66 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 4.79 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.34 109.885 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.464 -0.257 0 CA-C-O 121.247 0.436 . . . . 2.1 112.236 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.429 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 1.43 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 0.81 111.585 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' B' ' 6' ' ' LEU . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 0.61 107.116 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 1.32 110.579 178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.94 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.651 HG21 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.14 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 0.72 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.89 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 1.46 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 0.67 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.725 HG21 HG22 ' B' ' 38' ' ' VAL . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 0.72 109.304 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.1 109.746 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.49 111.804 -178.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.43 110.649 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 0.78 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.08 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.453 ' O ' HG12 ' B' ' 24' ' ' VAL . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.12 110.251 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.424 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 1.88 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.63 HG22 HG11 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.39 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.453 HG12 ' O ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.31 112.635 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.19 110.821 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.3 109.453 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.08 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.614 ' H ' HG23 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.25 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 46.6 m80 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 1.75 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.63 HG11 HG22 ' B' ' 23' ' ' VAL . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.35 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.451 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.58 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.27 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.2 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.05 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.54 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.5 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.725 HG22 HG21 ' B' ' 15' ' ' VAL . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 1.38 113.24 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.07 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 0.91 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' B' ' 9' ' ' VAL . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 0.73 111.315 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.4 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.03 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 0.84 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.56 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.651 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.88 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 1.6 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.09 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.39 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.503 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.83 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 0.63 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.33 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.03 111.483 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.92 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.21 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 0.99 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.09 112.236 174.692 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.446 -1.266 0 N-CA-C 110.461 -0.631 . . . . 2.43 110.461 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 0.76 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 0.99 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 1.51 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.67 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 0.71 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 0.68 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.4 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 1.47 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 0.77 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.37 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 0.77 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.33 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 1.32 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 1.44 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 0.77 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.38 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.08 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 2.55 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 1.63 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.38 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.61 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.7 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.1 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 1.98 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.38 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.11 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.32 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.13 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 1.75 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 0.99 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.34 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.45 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 1.45 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.87 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 0.88 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.71 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 1.47 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 0.93 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.99 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.2 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.23 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 1.88 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 0.84 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.1 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 4.72 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.618 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 0.66 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.46 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.45 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.484 HD22 HD13 ' B' ' 56' ' ' LEU . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 0.78 111.117 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.08 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.66 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 4.79 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.34 111.012 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo . . . . . 0 N--CA 1.445 -1.337 0 CA-C-O 121.186 0.411 . . . . 2.1 111.696 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 1.43 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.507 ' O ' HG23 ' B' ' 9' ' ' VAL . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 0.81 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' B' ' 6' ' ' LEU . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 0.61 107.827 178.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 1.32 109.438 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.94 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.599 ' HA ' HD12 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.14 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 0.72 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.89 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 1.46 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.514 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 0.67 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 0.72 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.1 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.49 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.43 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 0.78 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.08 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.12 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 1.88 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.511 HG22 HG11 ' B' ' 30' ' ' VAL . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.39 109.873 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.31 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.19 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.3 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.415 ' HB2' HD21 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.08 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.25 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 1.75 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.511 HG11 HG22 ' B' ' 23' ' ' VAL . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.35 108.967 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.58 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.27 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.2 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.05 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.54 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.5 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 1.38 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.07 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 0.91 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 0.73 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.4 111.109 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.03 111.588 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 0.84 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.56 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.636 ' HA ' HG22 ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.88 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 1.6 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.09 109.849 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.39 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.83 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 0.63 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.33 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.03 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.618 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.21 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 0.99 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.09 112.964 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo . . . . . 0 N--CA 1.455 -0.778 0 N-CA-C 109.699 -0.923 . . . . 2.43 109.699 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.03 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 0.76 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 0.99 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 1.51 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.67 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 0.71 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 0.68 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.4 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 1.47 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 0.77 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.37 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.412 HG21 ' HB ' ' A' ' 19' ' ' THR . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 0.77 116.011 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.33 110.864 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.45 ' HB2' HD12 ' A' ' 6' ' ' LEU . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 1.32 114.733 178.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 1.44 111.457 178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG21 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 0.77 111.542 -178.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' HG22 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.38 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.495 ' HB2' HD22 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.08 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 2.55 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.723 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 1.63 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.38 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.61 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.7 109.864 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.1 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 1.98 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.9 m80 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.38 110.789 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.11 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.32 112.597 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.13 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 1.75 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 0.99 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.34 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.45 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 1.45 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.87 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 0.88 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 0.71 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 0.93 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 0.99 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.2 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.23 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 1.88 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 0.84 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.1 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.597 HH11 HE22 ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 4.72 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 0.66 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.53 ' OE1' ' HA ' ' A' ' 51' ' ' ARG . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.46 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.597 HE22 HH11 ' A' ' 51' ' ' ARG . 78.1 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.45 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 0.78 112.888 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.08 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.66 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 4.79 110.125 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.34 112.185 179.467 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 CA-C-O 121.0 0.334 . . . . 2.1 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 1.43 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 0.81 110.8 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 0.61 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 1.32 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.94 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.14 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 0.72 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.89 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.442 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 1.46 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.458 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 0.67 113.236 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 0.72 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.1 110.521 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.49 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.43 111.121 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 0.78 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.406 HG13 HD22 ' B' ' 6' ' ' LEU . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.08 109.639 179.085 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.12 108.29 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 1.88 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.39 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.31 109.3 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.19 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.3 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.08 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.25 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 1.75 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.412 HG11 ' HA ' ' B' ' 23' ' ' VAL . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.35 112.421 -179.605 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.58 109.771 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.27 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.2 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.05 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.54 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.458 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.5 112.699 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 1.38 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.07 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 0.91 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 0.73 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.4 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.03 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 0.84 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.56 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.524 ' HA ' HG22 ' B' ' 4' ' ' VAL . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.88 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 1.6 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.437 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.09 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.39 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.437 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.83 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 0.63 111.046 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.33 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.03 112.171 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.21 110.061 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 0.99 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.09 113.711 178.323 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo . . . . . 0 C--O 1.234 0.295 0 CA-C-O 121.403 0.501 . . . . 2.43 112.189 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.588 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.03 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.76 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.53 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 0.99 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 1.51 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.556 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.67 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 0.71 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 0.68 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.4 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 1.47 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 0.77 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.37 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 0.77 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.33 110.332 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 1.32 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.5 tp60 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 1.44 110.461 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 0.77 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.38 109.488 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.517 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.08 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 2.55 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 20' ' ' VAL . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 1.63 111.365 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.38 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.61 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.7 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.1 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 1.98 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.38 110.58 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.11 110.135 -178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.32 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.13 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 1.75 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.599 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 0.99 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.34 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.45 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 1.45 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.87 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 0.88 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 0.71 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.704 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 1.47 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 0.93 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 0.99 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.2 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.588 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.23 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 1.88 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HB3' HG11 ' A' ' 24' ' ' VAL . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 0.84 113.278 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.1 109.512 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.581 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 4.72 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.636 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 0.66 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.46 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.45 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.65 HD22 HD13 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 0.78 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.08 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.66 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 4.79 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.34 111.267 -178.684 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.827 0.678 . . . . 2.1 113.491 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 1.43 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 0.81 111.099 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.499 HD22 ' CG1' ' B' ' 20' ' ' VAL . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 0.61 108.483 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 1.32 109.227 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.94 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.14 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 0.72 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.89 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 1.46 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 0.67 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 0.72 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.1 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.49 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.542 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 39.6 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.43 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 0.78 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.499 ' CG1' HD22 ' B' ' 6' ' ' LEU . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.08 109.979 178.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.12 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 1.88 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.39 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.31 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.19 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.3 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.08 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.25 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 1.75 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.35 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.58 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.27 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.2 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.05 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.614 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.54 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.5 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 1.38 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.07 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.606 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 0.91 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.73 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.4 111.717 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.03 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' GLU . . . . . 0.606 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 0.84 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.56 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.49 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.88 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 1.6 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.09 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.39 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.83 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 0.63 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.33 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.03 111.212 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.65 HD13 HD22 ' A' ' 56' ' ' LEU . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.21 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 0.99 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.09 113.786 178.89 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo . . . . . 0 CA--C 1.528 0.179 0 CA-C-O 121.004 0.335 . . . . 2.43 112.857 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.473 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.03 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 0.76 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.567 ' H ' HD23 ' A' ' 6' ' ' LEU . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 0.99 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 1.51 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.463 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.67 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 0.71 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 0.68 111.212 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.4 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 1.47 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 0.77 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.37 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 0.77 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.33 108.913 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.408 ' O ' HD12 ' A' ' 6' ' ' LEU . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 1.32 111.059 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.9 tp60 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 1.44 110.511 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 0.77 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.38 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.08 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 2.55 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 1.63 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.38 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.61 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.7 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.1 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 1.98 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.38 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.11 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.534 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.32 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.477 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.13 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 1.75 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.534 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 0.99 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.34 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.45 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 1.45 112.339 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.87 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 0.88 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 0.71 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 1.47 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 0.93 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.99 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.2 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.23 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 1.88 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 0.84 113.667 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.1 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 4.72 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.406 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 0.66 109.833 179.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.46 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.577 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.45 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.727 HD22 HD13 ' B' ' 56' ' ' LEU . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 0.78 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.08 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.66 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 4.79 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.518 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.34 114.076 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo . . . . . 0 CA--C 1.536 0.623 0 CA-C-O 121.112 0.38 . . . . 2.1 112.581 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' B' ' 47' ' ' TYR . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 1.43 110.974 178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.403 ' O ' HG23 ' B' ' 9' ' ' VAL . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 0.81 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 0.61 109.439 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 1.32 110.555 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.94 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 5' ' ' THR . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.14 110.931 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 0.72 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.89 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.426 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 1.46 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 0.67 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 0.72 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.1 112.046 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.49 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.43 111.629 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 0.78 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.08 110.823 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.12 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.686 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 1.88 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB2' ' B' ' 35' ' ' ARG . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.39 110.557 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.31 111.222 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.19 110.877 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.3 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.686 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.08 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.529 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.25 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 32.1 m80 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 1.75 111.846 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.436 HG11 HG22 ' B' ' 23' ' ' VAL . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.35 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.58 110.671 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.691 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.27 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.2 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.05 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.54 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.5 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 1.38 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.07 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 0.91 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 0.73 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.4 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.03 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.426 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 0.84 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ASN . . . . . 0.532 ' OD1' HD11 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.56 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 4' ' ' VAL . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.88 109.378 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.532 HD11 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 1.6 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.09 109.137 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.39 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.83 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 0.63 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.33 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.03 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 56' ' ' LEU . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.21 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 0.99 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.09 112.451 172.885 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.614 0.589 . . . . 2.43 112.859 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.03 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 0.76 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 20' ' ' VAL . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 0.99 111.591 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 1.51 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.67 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 0.71 110.225 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 0.68 111.752 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.4 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 1.47 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 0.77 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.37 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 0.77 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.33 109.393 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.402 ' O ' HD13 ' A' ' 6' ' ' LEU . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 1.32 111.075 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 1.44 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 0.77 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.496 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.38 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.08 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 2.55 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 1.63 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.38 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.61 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.7 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.1 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 1.98 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.38 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.32 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.13 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 1.75 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.604 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 0.99 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.34 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.45 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 1.45 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.87 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 0.88 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 0.71 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 1.47 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 0.93 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 0.99 111.45 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.2 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.23 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.439 HD13 ' HA ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 1.88 108.608 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 0.84 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.1 109.379 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 4.72 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.565 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 0.66 110.002 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.549 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.46 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.45 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.582 HD22 HD13 ' B' ' 56' ' ' LEU . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 0.78 112.135 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.08 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.66 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 4.79 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.34 111.853 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.56 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo . . . . . 0 N--CA 1.456 -0.7 0 CA-C-O 120.305 0.044 . . . . 2.1 112.142 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' B' ' 47' ' ' TYR . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 1.43 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 0.81 110.091 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.612 HD22 HG11 ' B' ' 20' ' ' VAL . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 0.61 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 1.32 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.94 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.14 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.72 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.89 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 1.46 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 0.67 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 0.72 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.1 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.49 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.43 112.228 -178.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.506 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 0.78 110.893 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.612 HG11 HD22 ' B' ' 6' ' ' LEU . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.08 110.016 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.12 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 1.88 110.495 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' B' ' 35' ' ' ARG . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.39 109.849 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.31 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.19 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.3 110.972 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.08 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.25 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 1.75 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 23' ' ' VAL . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.35 111.351 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.421 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.58 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.27 109.442 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.2 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.05 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.576 ' HA ' HG21 ' B' ' 23' ' ' VAL . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.54 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.5 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 1.38 112.599 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.07 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 0.91 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.73 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.4 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.03 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 0.84 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.56 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.546 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.88 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 1.6 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' PRO . . . . . 0.497 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.429 ' H ' HG22 ' B' ' 48' ' ' ILE . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.09 110.044 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.39 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.83 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 0.63 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.33 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.61 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.03 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.582 HD13 HD22 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.21 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 0.99 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.09 113.668 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo . . . . . 0 C--O 1.233 0.248 0 N-CA-C 113.271 0.45 . . . . 2.43 113.271 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.03 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 0.76 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.548 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 0.99 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 1.51 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.67 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 0.71 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.58 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 0.68 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.4 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 1.47 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 0.77 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.37 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 0.77 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.58 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.33 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.548 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 1.32 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.2 tp60 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 1.44 110.501 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 0.77 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.421 HG12 HG13 ' A' ' 38' ' ' VAL . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.38 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.08 111.995 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 2.55 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 1.63 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.38 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.61 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.7 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 1.98 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.38 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.11 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.32 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.13 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 1.75 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 0.99 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HE ' ' HG3' ' A' ' 36' ' ' GLU . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.34 110.016 178.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' HG3' ' HE ' ' A' ' 35' ' ' ARG . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.45 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 1.45 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.87 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 0.88 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.71 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 1.47 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 0.93 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 0.99 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.2 110.3 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.23 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 1.88 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 0.84 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.1 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.46 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 4.72 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.592 ' CA ' HD11 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.66 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.46 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.59 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.45 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.563 HD22 HD13 ' B' ' 56' ' ' LEU . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 0.78 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.08 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.66 113.245 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 4.79 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.34 114.015 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo . . . . . 0 N--CA 1.476 0.487 0 CA-C-O 120.889 0.287 . . . . 2.1 112.414 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 1.43 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 0.81 110.617 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' B' ' 6' ' ' LEU . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 0.61 107.61 177.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 1.32 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.94 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.14 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 0.72 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.89 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 1.46 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.538 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 0.67 113.89 -177.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 0.72 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.1 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.49 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.43 110.975 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 0.78 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.08 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.12 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.4 ' HB3' HG22 ' B' ' 30' ' ' VAL . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 1.88 110.348 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.501 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.39 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.31 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.19 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.472 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.3 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.472 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.08 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.408 ' H ' ' HB1' ' B' ' 27' ' ' ALA . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.25 114.186 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 1.75 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.501 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.35 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.542 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.58 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.27 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.2 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.542 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.05 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.54 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.5 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.538 ' HA ' ' HB2' ' B' ' 13' ' ' ALA . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 1.38 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.07 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 0.91 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 0.73 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.4 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.03 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 0.84 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.56 112.233 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.568 ' HA ' HG22 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.88 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 1.6 108.332 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' PRO . . . . . 0.445 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.586 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.09 108.907 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.39 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.83 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ALA . . . . . 0.586 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 0.63 109.969 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.33 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.03 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.592 HD11 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.21 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 0.99 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.09 109.099 -176.623 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.461 -0.397 0 CA-C-O 120.99 0.329 . . . . 2.43 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.405 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.03 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 0.76 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 0.99 112.311 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 1.51 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.67 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 0.71 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 0.68 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.4 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 1.47 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 0.77 112.96 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.37 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 0.77 109.956 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.33 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB2' HD13 ' A' ' 6' ' ' LEU . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 1.32 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 1.44 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 0.77 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.451 HG12 ' HB ' ' A' ' 38' ' ' VAL . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.38 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.08 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 2.55 111.233 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 35' ' ' ARG . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 1.63 109.984 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.4 HG12 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.38 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.61 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.598 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.7 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.1 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 1.98 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.38 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.11 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.32 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.13 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 1.75 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 0.99 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.34 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.45 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.451 ' HB ' HG12 ' A' ' 20' ' ' VAL . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 1.45 111.971 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.87 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 0.88 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 0.71 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 1.47 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 0.93 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 0.99 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.2 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.23 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 1.88 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 0.84 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.1 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 4.72 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 0.66 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.46 112.441 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.45 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 HD13 ' B' ' 56' ' ' LEU . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 0.78 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.08 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.66 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 4.79 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 . . . . . 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.34 111.111 -178.638 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 121.4 0.5 . . . . 2.1 112.951 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 1.43 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.505 ' O ' HG23 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 0.81 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 0.61 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 1.32 109.548 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.94 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.14 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.89 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.455 ' CD1' ' HB2' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 1.46 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 0.67 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.493 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 0.72 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.1 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.49 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.516 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.43 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 0.78 111.774 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.447 ' CG1' HD22 ' B' ' 6' ' ' LEU . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.08 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.546 ' O ' HG12 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.12 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 1.88 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.39 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.546 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.31 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.19 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.557 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.3 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.557 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.08 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.25 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 77.2 m80 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 1.75 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.35 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.58 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.711 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.27 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.2 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.05 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.54 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.5 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.493 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 1.38 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' B' ' 42' ' ' MET . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.07 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 0.91 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.455 ' HB2' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.73 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.594 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.4 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.03 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 0.84 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.56 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.588 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.88 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 1.6 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.09 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.39 110.44 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.83 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 0.63 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.33 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.03 112.262 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 0.99 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.09 113.792 179.893 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.454 -0.796 0 N-CA-C 110.666 -0.552 . . . . 2.43 110.666 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.429 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.03 109.987 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 0.76 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.607 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 0.99 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 1.51 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.429 ' HB2' HG12 ' A' ' 4' ' ' VAL . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.67 109.735 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 0.71 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 0.68 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.4 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 1.47 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 0.77 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.37 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 0.77 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.33 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.607 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 1.32 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 1.44 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 0.77 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.435 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.38 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.08 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HD3' HG23 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 2.55 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.607 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 1.63 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.38 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.515 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.61 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.515 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.7 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.1 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 1.98 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.38 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.472 HG23 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.11 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.426 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.32 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.13 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 1.75 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 0.99 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.34 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.45 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.435 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 1.45 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.87 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 0.88 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 0.71 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 1.47 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 0.93 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 0.99 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.2 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.23 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 1.88 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 0.84 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.1 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.464 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 4.72 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 0.66 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.46 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.45 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' B' ' 56' ' ' LEU . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 0.78 113.506 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.08 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.66 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 4.79 112.589 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.633 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.34 110.191 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.487 0 CA-C-O 121.2 0.417 . . . . 2.1 112.814 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 1.43 109.77 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 0.81 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.489 HD22 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 0.61 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 1.32 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.94 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.14 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.634 ' HB2' HG21 ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 0.72 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.89 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 1.46 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.45 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 0.67 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.459 HG21 HG22 ' B' ' 38' ' ' VAL . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 0.72 109.506 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.1 110.671 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.49 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.43 109.456 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 0.78 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.634 HG21 ' HB2' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.08 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.648 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.12 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 1.88 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 38' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.39 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.31 107.32 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.648 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.19 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.3 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.08 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.25 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 1.75 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.35 114.032 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.58 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.27 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.2 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.451 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.05 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.54 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.5 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 23' ' ' VAL . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 1.38 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.07 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 0.91 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 0.73 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.4 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.03 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 0.84 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.56 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.88 112.046 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 1.6 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.09 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.612 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.39 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.83 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 0.63 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.33 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.612 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.03 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' A' ' 56' ' ' LEU . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.21 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 0.99 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.09 110.107 179.484 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 CA-C-O 121.287 0.453 . . . . 2.43 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.03 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 0.76 110.614 178.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 0.99 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 1.51 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.67 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' THR . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 0.71 109.588 177.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 0.68 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.4 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 1.47 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 0.77 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.37 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 0.77 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.33 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.451 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 1.32 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 1.44 109.972 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 0.77 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 24' ' ' VAL . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.38 111.223 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.08 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HE ' HG23 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 2.55 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.624 ' HB ' HG11 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 1.63 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.38 109.947 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.61 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.7 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.1 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 1.98 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.38 109.216 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG23 ' HE ' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.11 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.432 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.32 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.13 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 1.75 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 0.99 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 35' ' ' ARG . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.34 110.843 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.45 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.624 HG11 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 1.45 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' MET . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.87 111.237 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 0.88 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 0.71 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' GLU . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 1.47 111.11 -178.316 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 0.93 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 0.99 110.71 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.2 110.512 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.23 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.427 HD12 ' HD2' ' A' ' 49' ' ' PRO . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 1.88 109.882 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 48' ' ' ILE . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 0.84 113.453 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.1 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 4.72 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 0.66 109.242 178.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.46 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.45 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' B' ' 56' ' ' LEU . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 0.78 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.08 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.66 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 4.79 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.54 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.34 110.212 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 C--O 1.223 -0.258 0 CA-C-O 120.57 0.154 . . . . 2.1 112.291 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 1.43 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 0.81 111.842 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' B' ' 6' ' ' LEU . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 0.61 108.725 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 1.32 109.941 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.94 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.14 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 0.72 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.89 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 1.46 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 0.67 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 0.72 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.1 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.49 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.43 111.299 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 0.78 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.08 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.12 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 1.88 110.279 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.39 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.31 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.19 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.3 111.241 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.08 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.25 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 1.75 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.35 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.58 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.27 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.2 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.05 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.54 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.5 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 1.38 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.07 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 0.91 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 0.73 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.4 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.03 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 0.84 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.56 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.88 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 1.6 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.466 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.09 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.39 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.83 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.63 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.33 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.03 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' A' ' 56' ' ' LEU . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.21 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 0.99 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.09 111.539 -178.701 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 C--O 1.235 0.33 0 N-CA-C 111.176 -0.355 . . . . 2.43 111.176 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.563 HG12 ' HB2' ' A' ' 8' ' ' ASP . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.03 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 0.76 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.493 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 0.99 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 1.51 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.563 ' HB2' HG12 ' A' ' 4' ' ' VAL . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.67 109.385 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 0.71 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 0.68 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.4 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 1.47 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 0.77 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.37 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 0.77 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.33 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.493 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 1.32 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 20.8 tp60 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 1.44 110.254 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 0.77 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.505 ' O ' HG23 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.38 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.08 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 2.55 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.444 HG21 ' CG2' ' A' ' 38' ' ' VAL . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 1.63 110.527 -178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.38 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.61 109.874 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.7 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.1 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 1.98 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.38 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.11 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.32 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.13 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 1.75 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 0.99 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.34 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.45 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.444 ' CG2' HG21 ' A' ' 23' ' ' VAL . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 1.45 110.899 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.87 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 0.88 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 0.71 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 1.47 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 0.93 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HB3' HG11 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 0.99 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.2 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.23 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 1.88 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 0.84 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.1 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 4.72 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 0.66 110.096 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.46 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.45 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.481 HD22 HD13 ' B' ' 56' ' ' LEU . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 0.78 112.076 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.08 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.66 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 54' ' ' GLN . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 4.79 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.34 111.918 -178.787 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 N--CA 1.454 -0.811 0 N-CA-C 111.175 -0.356 . . . . 2.1 111.175 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 1.43 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.65 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 0.81 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 6' ' ' LEU . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.61 109.92 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 1.32 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.94 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.14 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 0.72 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.89 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 1.46 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 0.67 112.429 -178.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 0.72 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' SER . . . . . 0.425 ' HB2' ' OG1' ' B' ' 19' ' ' THR . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.1 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.49 112.8 -178.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.43 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 0.78 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.08 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.12 110.66 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 1.88 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.573 HG22 HG11 ' B' ' 30' ' ' VAL . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.39 110.537 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.31 112.682 -178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.457 ' CG ' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.19 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.457 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.3 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.08 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.25 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 1.75 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.573 HG11 HG22 ' B' ' 23' ' ' VAL . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.35 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.499 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.58 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.27 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.2 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.05 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.54 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.5 111.943 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 1.38 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.07 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.91 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 0.73 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.4 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.03 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.84 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.56 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.88 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.404 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 1.6 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 49' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.09 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.39 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.83 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 0.63 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.33 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.03 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.21 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 0.99 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.09 114.447 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo . . . . . 0 C--O 1.236 0.393 0 CA-C-O 120.834 0.264 . . . . 2.43 111.631 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.03 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 0.76 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.665 HD22 ' OG ' ' A' ' 21' ' ' SER . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 0.99 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 1.51 110.368 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.67 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 0.71 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 0.68 112.015 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.4 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 1.47 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 0.77 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.37 111.558 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 0.77 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.33 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 1.32 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 1.44 112.286 -178.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 0.77 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.38 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.665 ' OG ' HD22 ' A' ' 6' ' ' LEU . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.08 113.376 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 22' ' ' ARG . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 2.55 111.727 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 38' ' ' VAL . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 1.63 110.55 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 49' ' ' PRO . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.38 110.805 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.61 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.7 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.1 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 1.98 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.38 108.264 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.11 111.865 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.32 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.13 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 1.75 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 0.99 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.34 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.45 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 23' ' ' VAL . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 1.45 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.87 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 0.88 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 0.71 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 1.47 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 0.93 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 0.99 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.2 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.553 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.23 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 1.88 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HB3' HG11 ' A' ' 24' ' ' VAL . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 0.84 111.804 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.1 110.169 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 4.72 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.426 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 0.66 110.694 178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.46 112.742 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.45 110.25 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 56' ' ' LEU . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 0.78 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.08 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.66 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 4.79 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.34 113.339 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.415 ' O ' HG22 ' B' ' 4' ' ' VAL . 87.4 Cg_endo . . . . . 0 N--CA 1.463 -0.286 0 N-CA-C 112.325 0.086 . . . . 2.1 112.325 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.631 HG22 ' HA ' ' B' ' 47' ' ' TYR . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 1.43 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.406 ' N ' HG23 ' B' ' 4' ' ' VAL . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 0.81 110.005 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.57 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 0.61 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 1.32 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.94 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.14 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 0.72 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.89 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 1.46 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 0.67 112.337 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 0.72 109.991 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.1 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.444 ' O ' HG12 ' B' ' 20' ' ' VAL . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.49 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.43 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 0.78 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.444 HG12 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.08 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.12 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 1.88 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' B' ' 35' ' ' ARG . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.39 109.538 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.31 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.19 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.3 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.08 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.25 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 1.75 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.466 HG11 HG22 ' B' ' 23' ' ' VAL . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.35 109.831 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' SER . . . . . 0.514 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.58 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.27 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.2 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.05 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.54 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.5 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 1.38 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.07 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 0.91 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 0.73 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.4 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.03 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 0.84 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.56 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.631 ' HA ' HG22 ' B' ' 4' ' ' VAL . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.88 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 1.6 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.09 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.39 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.83 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 0.63 109.916 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.658 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.33 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.03 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.669 HD13 HD22 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.21 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 0.99 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.09 113.787 177.863 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 C--O 1.234 0.323 0 N-CA-C 111.18 -0.354 . . . . 2.43 111.18 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.03 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.419 ' O ' HG23 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 0.76 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 0.99 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 1.51 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.67 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 0.71 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 0.68 111.149 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.4 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.47 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 0.77 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.37 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 0.77 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.33 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.498 ' O ' HD12 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 1.32 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 1.44 110.478 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 0.77 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.38 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.456 ' HA ' HG23 ' A' ' 24' ' ' VAL . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.08 111.364 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 2.55 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 1.63 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.486 HG13 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.38 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.61 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.551 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.7 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.1 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 1.98 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.38 112.343 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.11 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.32 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.13 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 1.75 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 0.99 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.34 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.45 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 1.45 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.87 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 0.88 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 0.71 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 1.47 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 0.93 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 0.99 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.2 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.23 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 1.88 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 0.84 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.1 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 4.72 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 0.66 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.46 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.45 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.547 HD22 HD13 ' B' ' 56' ' ' LEU . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 0.78 111.827 178.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.08 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.66 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 4.79 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.34 111.304 178.819 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.457 -0.655 0 CA-C-O 121.446 0.519 . . . . 2.1 111.938 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 1.43 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.517 ' O ' HG23 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 0.81 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 0.61 110.155 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 1.32 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.94 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.14 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ALA . . . . . 0.453 ' HA ' HG21 ' B' ' 20' ' ' VAL . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 0.72 112.077 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.89 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 1.46 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 0.67 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 0.72 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.1 112.6 -178.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.49 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.43 111.509 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.422 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 0.78 111.856 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.453 HG21 ' HA ' ' B' ' 10' ' ' ALA . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.08 111.255 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.12 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.576 ' HG2' ' HB3' ' B' ' 27' ' ' ALA . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 1.88 111.156 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 19' ' ' THR . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.39 108.309 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.31 110.436 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.19 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.3 113.139 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.576 ' HB3' ' HG2' ' B' ' 22' ' ' ARG . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.08 112.187 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.25 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 1.75 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 27' ' ' ALA . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.35 109.696 175.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.58 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.422 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.27 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.2 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG13 ' B' ' 38' ' ' VAL . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.05 112.661 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.422 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.54 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.5 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.408 HG13 ' O ' ' B' ' 34' ' ' THR . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 1.38 110.685 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.07 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 0.91 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 0.73 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.4 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.03 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 0.84 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.56 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.88 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 1.6 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.705 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.09 109.162 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.48 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.39 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.83 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 0.63 111.569 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.33 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.03 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.21 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 0.99 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.09 111.381 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 CA-C-O 121.192 0.414 . . . . 2.43 111.667 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 4' ' ' VAL . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.03 108.983 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 0.76 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 0.99 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 1.51 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.67 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 0.71 110.504 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 0.68 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.4 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 1.47 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 0.77 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.37 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.489 HG11 ' CG2' ' A' ' 34' ' ' THR . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 0.77 110.02 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.33 110.895 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.587 ' HB2' HD12 ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 1.32 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 58.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 1.44 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 0.77 110.381 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.693 ' O ' HG22 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.38 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 2.55 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 1.63 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.38 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.61 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.7 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.1 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 1.98 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.38 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.11 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.32 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.13 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 1.75 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.489 ' CG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 0.99 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.34 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.45 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 1.45 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.87 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 0.88 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 0.71 111.851 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 1.47 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 0.93 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 0.99 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.2 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.23 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 1.88 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.631 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 0.84 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.1 109.464 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.64 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 4.72 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 0.66 112.566 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 11.5 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.46 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.45 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.829 HD22 HD13 ' B' ' 56' ' ' LEU . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 0.78 111.129 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.08 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.66 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 4.79 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.34 111.234 -179.649 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.529 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo . . . . . 0 N--CA 1.45 -1.082 0 CA-C-O 120.745 0.227 . . . . 2.1 111.538 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 1.43 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 0.81 110.572 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 0.61 109.035 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 1.32 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.94 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.422 ' H ' HG23 ' B' ' 9' ' ' VAL . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.14 110.652 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.72 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.89 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 1.46 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 0.67 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 0.72 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.1 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.49 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.43 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 0.78 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.08 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.629 ' O ' HG12 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.12 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.456 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 1.88 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.39 110.755 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.629 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.31 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.19 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.3 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' ALA . . . . . 0.513 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.08 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.444 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.25 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' B' ' 28' ' ' SER . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 1.75 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 27' ' ' ALA . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.35 110.968 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.58 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.27 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.2 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.05 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.54 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.5 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 1.38 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.07 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 0.91 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 0.73 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.4 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.03 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 0.84 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.56 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.88 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.529 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 1.6 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.09 108.029 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.39 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.83 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 0.63 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.33 111.949 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.03 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.829 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.21 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 0.99 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.09 113.997 -177.602 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 111.248 -0.328 . . . . 2.43 111.248 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.03 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 0.76 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 0.99 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 1.51 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.67 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 0.71 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 0.68 111.71 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.4 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 1.47 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 0.77 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.37 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 0.77 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.33 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HB2' HD12 ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 1.32 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 28.8 tp60 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 1.44 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG11 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 0.77 112.142 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.38 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.08 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 2.55 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 1.63 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.38 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.61 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.7 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.1 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 1.98 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.38 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 HH11 ' A' ' 22' ' ' ARG . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.11 111.029 -178.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.32 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.13 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 1.75 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 0.99 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.34 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.45 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.442 HG23 HG11 ' A' ' 23' ' ' VAL . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 1.45 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.87 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 0.88 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 0.71 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.445 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 1.47 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 0.93 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.478 ' O ' HG21 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 0.99 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.2 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.23 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 1.88 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 0.84 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.481 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.1 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 4.72 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 0.66 111.132 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.46 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 92.3 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.45 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.624 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 0.78 111.762 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.08 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.66 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 4.79 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.41 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 23.4 mp0 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.34 111.548 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 N--CA 1.451 -0.98 0 CA-C-O 121.283 0.451 . . . . 2.1 112.732 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.407 ' H ' HG12 ' B' ' 4' ' ' VAL . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 1.43 108.609 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 0.81 111.593 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 0.61 108.366 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 1.32 109.501 177.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.94 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.14 109.956 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 0.72 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.89 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 1.46 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 0.67 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.459 HG11 HG23 ' B' ' 34' ' ' THR . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 0.72 109.648 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.1 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.49 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.43 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.427 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 0.78 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.568 ' O ' HG12 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.08 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.12 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.427 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 1.88 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.568 HG12 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.39 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.31 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.19 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.3 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.08 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.25 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 45.4 m80 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 1.75 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.35 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.58 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.27 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.2 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.459 HG23 HG11 ' B' ' 15' ' ' VAL . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.05 110.367 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.54 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.5 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 1.38 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.07 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.91 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 0.73 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.4 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.03 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 0.84 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.56 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.88 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 1.6 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.705 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.09 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.39 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.83 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 0.63 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.705 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.33 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.03 111.676 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.624 HD13 HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.21 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 0.99 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.09 113.469 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 C--O 1.239 0.533 0 CA-C-O 121.206 0.419 . . . . 2.43 111.934 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 0.76 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.416 HD22 ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 0.99 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 1.51 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.67 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.441 ' H ' HG23 ' A' ' 9' ' ' VAL . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.71 109.13 177.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 0.68 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.4 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 1.47 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 0.77 111.945 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.37 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 13' ' ' ALA . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 0.77 110.047 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.33 110.499 178.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB2' HD22 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 1.32 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 1.44 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 0.77 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.38 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.434 ' HA ' HG22 ' A' ' 24' ' ' VAL . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.08 110.593 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 2.55 110.328 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 1.63 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 21' ' ' SER . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.38 111.044 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.61 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.7 112.647 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.1 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 1.98 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.38 110.044 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.11 109.813 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.515 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.32 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.13 112.162 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 1.75 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 0.99 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.34 110.757 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.45 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 1.45 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.87 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.88 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 0.71 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 1.47 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 0.93 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.99 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.2 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.23 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 1.88 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 0.84 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.1 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.477 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 4.72 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.461 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 0.66 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.46 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.45 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 0.78 109.487 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.08 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.66 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 4.79 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.34 108.701 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.441 -1.596 0 N-CA-C 113.032 0.359 . . . . 2.1 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 4' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 1.43 109.209 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 0.81 111.399 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 0.61 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 1.32 108.546 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.94 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.14 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 0.72 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.89 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.426 ' HB2' HD11 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 1.46 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 0.67 111.433 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 0.72 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.1 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.49 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.43 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.407 ' HA ' ' HB2' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 0.78 111.072 -179.346 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.08 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.12 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' B' ' 19' ' ' THR . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 1.88 111.802 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.701 HG11 HG21 ' B' ' 38' ' ' VAL . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.39 109.32 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.31 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.19 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.3 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.08 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.25 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.0 m80 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 1.75 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.35 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.58 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.27 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.2 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.05 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.54 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.5 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.701 HG21 HG11 ' B' ' 23' ' ' VAL . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 1.38 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.07 110.202 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 0.91 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 0.73 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.4 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.03 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 0.84 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.56 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.451 ' HA ' HG22 ' B' ' 4' ' ' VAL . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.88 110.65 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 1.6 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.559 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.09 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.39 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.559 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.83 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 0.63 110.711 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.33 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.03 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.21 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 0.99 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.09 114.379 179.749 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 CA-C-O 121.015 0.34 . . . . 2.43 112.073 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.03 108.632 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.477 ' O ' HG23 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 0.76 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.455 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 0.99 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 1.51 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.67 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 0.71 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.68 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.4 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 1.47 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 0.77 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.37 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 0.77 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.33 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.455 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 1.32 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.3 tp60 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 1.44 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 0.77 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.604 ' O ' HG22 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.38 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.08 113.321 -178.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.48 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 2.55 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 1.63 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.38 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.61 113.037 -178.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.7 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.1 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 1.98 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.38 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.48 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.11 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.32 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.13 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 1.75 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 0.99 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.34 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.45 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.432 ' HB ' HG12 ' A' ' 20' ' ' VAL . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 1.45 112.175 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.87 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 0.88 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 0.71 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.618 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 1.47 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 0.93 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 0.99 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.2 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.23 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 1.88 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 0.84 111.905 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.1 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 4.72 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.579 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 0.66 112.257 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.568 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.46 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.45 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.753 HD22 HD13 ' B' ' 56' ' ' LEU . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 0.78 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.08 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.66 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 4.79 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.34 112.893 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.448 -1.152 0 CA-C-O 120.962 0.318 . . . . 2.1 112.154 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 1.43 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 0.81 111.699 -177.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 6' ' ' LEU . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 0.61 108.695 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 1.32 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.94 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.14 110.632 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 0.72 111.625 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.89 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 1.46 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 0.67 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 0.72 110.331 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.1 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.49 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.513 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.43 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.78 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.08 111.179 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.12 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 1.88 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.517 HG11 ' HB ' ' B' ' 38' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.39 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.31 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.19 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.3 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.08 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.25 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 1.75 109.744 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.466 ' CG1' HG22 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.35 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.58 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' ALA . . . . . 0.681 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.27 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.501 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.2 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.05 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.681 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.54 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.501 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.5 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.517 ' HB ' HG11 ' B' ' 23' ' ' VAL . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 1.38 112.14 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.07 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 0.91 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 0.73 110.476 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.4 110.554 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.03 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 0.84 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.56 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.88 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 1.6 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.09 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.39 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.42 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.83 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 0.63 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.33 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.03 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.21 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 0.99 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.09 112.715 -178.96 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 CA--C 1.53 0.293 0 CA-C-O 121.021 0.342 . . . . 2.43 112.05 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.03 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 0.76 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 0.99 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 1.51 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.474 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.67 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 0.71 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 0.68 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.4 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 1.47 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 0.77 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.37 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 0.77 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.33 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 1.32 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 1.44 110.687 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 0.77 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.38 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.08 111.974 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 2.55 111.023 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 1.63 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.38 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.61 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.7 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.1 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 1.98 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.38 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.11 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.32 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.13 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 1.75 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 0.99 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.596 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.34 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.45 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 1.45 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.87 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 0.88 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.71 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 1.47 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 0.93 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 0.99 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.2 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.23 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 1.88 109.994 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 0.84 112.606 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.1 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 4.72 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 0.66 109.762 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.46 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.474 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.45 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.712 HD22 HD13 ' B' ' 56' ' ' LEU . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 0.78 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.08 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.66 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 4.79 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.34 110.977 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo . . . . . 0 N--CA 1.471 0.199 0 CA-C-O 120.759 0.233 . . . . 2.1 111.688 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 1.43 111.442 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' THR . . . . . 0.415 ' O ' HG23 ' B' ' 9' ' ' VAL . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 0.81 110.236 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 0.61 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 1.32 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.94 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.419 HG23 ' H ' ' B' ' 9' ' ' VAL . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.14 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 0.72 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.89 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' TYR . . . . . 0.424 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 1.46 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 0.67 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 0.72 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.1 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' TYR . . . . . 0.432 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.49 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.43 111.828 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 0.78 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.08 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.12 110.619 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 1.88 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.69 HG11 HG21 ' B' ' 38' ' ' VAL . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.39 110.183 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.31 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.19 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.3 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.08 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.25 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 52.5 m80 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 1.75 115.364 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.443 HG13 ' CB ' ' B' ' 22' ' ' ARG . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.35 111.315 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.58 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.27 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.2 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.05 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.54 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.5 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.69 HG21 HG11 ' B' ' 23' ' ' VAL . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 1.38 111.231 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.07 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 0.91 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.73 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.4 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.03 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 0.84 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.56 112.02 -178.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' TYR . . . . . 0.41 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.88 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 1.6 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.428 ' O ' ' HB3' ' B' ' 54' ' ' GLN . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.09 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.39 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.83 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 0.63 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.33 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.568 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.03 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.712 HD13 HD22 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.21 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 0.99 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.09 112.445 174.435 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo . . . . . 0 C--O 1.236 0.375 0 CA-C-O 121.169 0.404 . . . . 2.43 112.765 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.03 108.898 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 0.76 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 0.99 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 1.51 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.482 ' HB2' HG12 ' A' ' 4' ' ' VAL . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.67 109.98 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.461 ' HB ' HG21 ' A' ' 20' ' ' VAL . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 0.71 110.774 179.134 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.68 110.913 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.4 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.56 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 1.47 110.165 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.58 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 0.77 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.37 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 0.77 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.33 109.753 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.428 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 1.32 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 1.44 110.182 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 0.77 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG21 ' HB ' ' A' ' 9' ' ' VAL . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.38 110.564 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.08 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 2.55 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 1.63 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.38 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.61 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.7 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.1 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 1.98 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.38 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.11 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.32 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.13 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 1.75 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 0.99 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.34 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.58 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.45 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 1.45 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.87 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 0.88 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.56 ' HB1' ' HD2' ' A' ' 12' ' ' TYR . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 0.71 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 1.47 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 0.93 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 0.99 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.2 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.23 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 1.88 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 0.84 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.1 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 4.72 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.66 109.619 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.46 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.682 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.45 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.657 HD22 HD13 ' B' ' 56' ' ' LEU . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 0.78 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.08 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.411 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.66 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.682 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 4.79 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HG3' ' HB3' ' A' ' 55' ' ' GLN . 5.0 mt-30 . . . . . 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.34 110.448 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo . . . . . 0 N--CA 1.458 -0.566 0 CA-C-O 121.635 0.598 . . . . 2.1 113.099 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 1.43 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 0.81 110.394 -177.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.52 ' HA ' HD23 ' B' ' 6' ' ' LEU . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 0.61 108.956 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 1.32 109.689 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.94 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' VAL . . . . . 0.44 ' H ' HG23 ' B' ' 9' ' ' VAL . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.14 111.698 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 0.72 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.89 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 1.46 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 0.67 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 0.72 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' SER . . . . . 0.465 ' O ' HG23 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.1 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.49 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.502 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.43 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 0.78 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.08 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.12 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 1.88 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' VAL . . . . . 0.443 HG22 HG11 ' B' ' 30' ' ' VAL . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.39 109.961 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.31 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.19 110.993 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.3 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.08 113.117 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.25 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 1.75 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.443 HG11 HG22 ' B' ' 23' ' ' VAL . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.35 109.849 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.58 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.27 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.2 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.05 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.54 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.5 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 1.38 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.07 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 0.91 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 0.73 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.4 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.03 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 45' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' B' ' 46' ' ' ASN . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 0.84 112.021 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 46' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 45' ' ' LEU . 24.0 t-20 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.56 110.76 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.88 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 1.6 107.421 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ASN . . . . . 0.473 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.09 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.39 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' CYS . . . . . 0.473 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.83 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 0.63 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.33 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.03 110.695 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.657 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.21 109.753 179.463 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 0.99 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.09 111.167 -179.841 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.63 0.252 . . . . 5.8 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 47.6 tttt -75.55 121.44 85.13 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.265 -0.425 . . . . 5.35 110.701 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 9.0 Cg_exo -69.19 102.88 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 121.843 1.695 . . . . 2.43 110.2 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.03 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 0.76 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.459 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 0.99 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 1.51 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.67 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 0.71 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.445 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 0.68 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.4 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 1.47 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 0.77 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.37 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 0.77 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.33 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 1.32 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 1.44 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 0.77 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.71 HG12 HG13 ' A' ' 38' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.38 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.08 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 2.55 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 1.63 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.38 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.61 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.7 110.148 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.415 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.1 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.98 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.449 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.38 110.023 -179.117 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.11 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.32 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.13 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 1.75 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 0.99 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.34 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.45 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.71 HG13 HG12 ' A' ' 20' ' ' VAL . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 1.45 112.084 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.87 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 0.88 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 0.71 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 1.47 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 0.93 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 0.99 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.2 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.23 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 1.88 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 0.84 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.581 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.1 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 4.72 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.524 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 0.66 111.112 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.46 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.602 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.45 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.794 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 0.78 111.575 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.08 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.66 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 4.79 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.602 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 6.2 mp0 79.76 28.56 0.31 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.34 110.239 177.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.06 91.35 6.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.472 -0.785 . . . . 3.86 110.361 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 tp . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.373 -0.822 . . . . 6.96 110.341 -179.149 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.169 -0.308 . . . . 6.92 110.169 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' B' ' 2' ' ' LYS . 24.2 mmtp -88.45 -59.43 0.26 Allowed Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 109.721 -0.474 . . . . 6.42 109.721 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' B' ' 2' ' ' LYS . 33.4 Cg_endo -67.6 88.37 0.34 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.916 1.744 . . . . 2.1 112.116 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 1.43 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.561 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 0.81 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 0.61 109.175 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 1.32 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.94 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' B' ' 41' ' ' ALA . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.14 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.72 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.89 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.412 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 1.46 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 0.67 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 0.72 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.469 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.1 110.594 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.482 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.49 111.03 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.431 ' CB ' ' H73' ' D' ' 6' ' ' ' DT' . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.43 111.343 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 0.78 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.08 111.466 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.12 109.982 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.558 ' HB3' HG22 ' B' ' 30' ' ' VAL . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 1.88 110.573 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.459 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.39 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.31 110.22 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.19 110.758 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.3 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.08 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.25 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 1.75 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.558 HG22 ' HB3' ' B' ' 22' ' ' ARG . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.35 111.857 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.58 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.694 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.27 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.2 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.05 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.694 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.54 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.5 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' B' ' 23' ' ' VAL . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 1.38 113.948 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.07 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 0.91 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.554 ' HB3' HG13 ' B' ' 9' ' ' VAL . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 0.73 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.4 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.03 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 0.84 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.56 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.471 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.88 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 1.6 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.09 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.39 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.83 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 0.63 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 59' ' ' LYS . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.33 111.143 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.526 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.03 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 56' ' ' LEU . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.21 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 0.99 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.36 17.37 6.19 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.09 113.382 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 54' ' ' GLN . 29.5 mttp -114.26 105.18 12.86 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 109.018 -0.734 . . . . 5.92 109.018 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -70.93 78.19 0.64 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.31 -0.859 . . . . 4.83 109.972 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m -98.36 -13.76 20.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.322 -0.854 . . . . 6.09 111.491 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 18.4 mt . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.572 -0.727 . . . . 7.79 109.521 179.234 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.489 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.449 -2.322 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.489 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.501 -1.437 0 C3'-C2'-C1' 99.602 -2.213 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.438 H2'' ' H8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 99.622 -2.199 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.597 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.138 0 C3'-C2'-C1' 99.292 -2.434 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.597 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.888 0 C3'-C2'-C1' 98.856 -2.746 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.532 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.653 0 C3'-C2'-C1' 99.428 -2.337 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.556 -2.245 . . . . 0.92 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.333 -2.405 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.106 0 C3'-C2'-C1' 99.469 -2.308 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.267 0 C3'-C2'-C1' 99.73 -2.121 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.566 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.938 0 C3'-C2'-C1' 100.003 -1.926 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.566 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.86 0 C3'-C2'-C1' 98.554 -2.962 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.022 0 C3'-C2'-C1' 99.472 -2.306 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.436 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C3'-C2'-C1' 99.044 -2.611 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.436 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 99.546 -2.253 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 C3'-C2'-C1' 99.894 -2.004 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.418 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.821 0 C3'-C2'-C1' 99.457 -2.317 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.531 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.083 -2.584 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.531 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.25 -2.464 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.491 H2'' ' C5 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 O4'-C1'-C2' 103.891 -2.008 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.491 ' C5 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.474 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.513 -2.277 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 N19-C1'-C2' 115.831 1.019 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.709 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 C3'-C2'-C1' 100.617 -1.488 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.709 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.845 -0.611 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.634 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.337 -0.973 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.634 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 O4'-C1'-C2' 104.599 -1.364 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.439 -0.662 0 C3'-C2'-C1' 105.049 1.678 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.551 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 C3'-C2'-C1' 105.262 1.83 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.551 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 C3'-C2'-C1' 104.824 1.517 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.751 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 105.541 2.03 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.751 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.939 0 O4'-C1'-C2' 106.981 0.801 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.623 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C4'-C3'-O3' 113.502 1.455 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.623 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 P-O3'-C3' 120.892 0.993 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.794 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.406 -1.11 0 C1'-O4'-C4' 106.887 -2.01 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.503 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 104.966 1.619 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.281 1.081 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.615 0.655 0 C4'-C3'-C2' 104.245 1.045 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C4'-C3'-C2' 101.835 -1.365 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.406 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 100.742 -1.398 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.489 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 C2'-C3'-O3' 112.514 0.709 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 N19-C1'-C2' 115.824 1.015 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 104.399 1.199 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.956 0 C3'-C2'-C1' 99.598 -2.216 . . . . 2.14 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 O4'-C1'-C2' 105.254 -0.769 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.512 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.2 mmm . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 110.266 -0.272 . . . . 5.8 110.266 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -102.8 100.92 17.95 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.254 -0.43 . . . . 5.35 110.0 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HD3' ' O ' ' A' ' 1' ' ' MET . 1.2 Cg_endo -80.16 65.78 8.87 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 2.43 113.772 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.03 109.766 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 0.76 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.603 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 0.99 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 1.51 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.67 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 0.71 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 0.68 111.164 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.4 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 1.47 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 0.77 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.37 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 0.77 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.424 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.33 109.876 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.603 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 1.32 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.436 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.0 tp-100 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 1.44 111.058 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 0.77 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.416 HG12 ' HB ' ' A' ' 38' ' ' VAL . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.38 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.08 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 2.55 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 35' ' ' ARG . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 1.63 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.38 109.329 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.61 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.7 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.486 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.1 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 1.98 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.584 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.38 111.029 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.11 112.795 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.32 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.13 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 1.75 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 0.99 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.618 ' HA ' HG21 ' A' ' 23' ' ' VAL . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.34 109.601 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.45 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 20' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 1.45 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.87 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 0.88 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.71 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 1.47 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 0.93 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 0.99 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.2 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.23 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 1.88 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 0.84 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.1 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 4.72 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 0.66 113.039 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.46 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.45 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.92 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 0.78 112.412 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.418 ' HB2' ' O2 ' ' D' ' 13' ' ' ' DC' . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.08 113.241 -178.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.66 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 4.79 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.567 ' NE2' " H5'" ' C' ' 11' ' ' ' DG' . 1.0 OUTLIER -69.86 -39.35 76.42 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.34 109.885 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.91 138.52 37.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.509 -0.769 . . . . 3.86 110.187 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.547 HD21 ' SD ' ' B' ' 1' ' ' MET . 1.6 pt? . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.931 -0.577 . . . . 6.96 109.623 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.547 ' SD ' HD21 ' A' ' 62' ' ' LEU . 21.2 mmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 110.045 -0.354 . . . . 6.92 110.045 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -134.71 120.4 14.38 Favored Pre-proline 0 C--N 1.323 -0.564 0 C-N-CA 120.96 -0.296 . . . . 6.42 111.727 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.41 -168.16 0.54 Allowed 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 123.641 2.894 . . . . 2.1 112.236 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.429 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 1.43 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.627 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 0.81 111.585 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.455 ' HA ' HD23 ' B' ' 6' ' ' LEU . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 0.61 107.116 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 1.32 110.579 178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.94 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.651 HG21 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.14 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 0.72 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.89 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 1.46 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 0.67 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.725 HG21 HG22 ' B' ' 38' ' ' VAL . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 0.72 109.304 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.1 109.746 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.469 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.49 111.804 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.426 ' HG3' ' H62' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.43 110.649 178.631 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 0.78 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.08 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.453 ' O ' HG12 ' B' ' 24' ' ' VAL . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.12 110.251 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.424 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 1.88 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.63 HG22 HG11 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.39 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.453 HG12 ' O ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.31 112.635 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.19 110.821 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.3 109.453 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.08 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.614 ' H ' HG23 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.25 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 1.75 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.63 HG11 HG22 ' B' ' 23' ' ' VAL . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.35 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.451 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.58 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.27 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.2 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.05 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.54 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.5 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.725 HG22 HG21 ' B' ' 15' ' ' VAL . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 1.38 113.24 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.07 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 0.91 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' B' ' 9' ' ' VAL . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 0.73 111.315 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.4 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.03 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 0.84 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.56 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.651 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.88 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 1.6 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.09 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.39 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.503 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.83 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 0.63 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.33 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.47 ' OE1' ' HE3' ' B' ' 59' ' ' LYS . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.03 111.483 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.92 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.21 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 0.99 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 174.92 40.05 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.09 112.236 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.47 ' HE3' ' OE1' ' B' ' 55' ' ' GLN . 0.3 OUTLIER -119.54 97.28 5.57 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.247 0.546 . . . . 5.92 109.813 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 22.5 mp0 -90.8 100.33 13.21 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.46 -0.791 . . . . 4.83 110.005 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.35 74.46 8.35 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 112.055 0.391 . . . . 6.09 112.055 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 29.2 tp . . . . . 0 C--O 1.244 0.798 0 CA-C-N 115.084 -0.962 . . . . 7.79 111.163 179.162 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.433 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.193 0 C3'-C2'-C1' 98.728 -2.837 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.508 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 99.671 -2.164 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.599 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 99.909 -1.994 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.599 ' C8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 P--O3' 1.621 1.152 0 C3'-C2'-C1' 99.953 -1.962 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.501 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.142 -2.541 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.51 H2'' ' C6 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.914 -1.99 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.51 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.016 -2.631 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.332 -2.406 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.105 -2.568 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.411 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.456 0 C3'-C2'-C1' 99.478 -2.302 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.489 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.368 0 C3'-C2'-C1' 100.116 -1.846 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.742 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.043 0 C3'-C2'-C1' 99.785 -2.082 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.61 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.286 0 C3'-C2'-C1' 98.729 -2.837 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.524 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 99.907 -1.995 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.524 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.647 -2.181 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.426 ' H62' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.719 0 O4'-C1'-C2' 103.88 -2.019 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.528 -2.265 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.483 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.099 0 C3'-C2'-C1' 99.052 -2.606 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.624 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.555 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.624 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-C2' 103.964 -1.942 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.583 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.46 -2.314 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.408 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -1.016 0 C3'-C2'-C1' 99.509 -2.279 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-C2' 105.142 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.519 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 100.623 -1.484 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.519 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C5'-C4'-C3' 116.161 0.974 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.711 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-C2' 104.911 -1.081 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.711 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.579 1.379 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.698 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 O4'-C1'-C2' 107.246 1.042 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 P--O3' 1.62 1.107 0 C3'-C2'-C1' 105.583 2.06 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.604 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.524 0.622 0 C4'-C3'-C2' 104.896 1.696 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.669 1.469 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.584 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 O4'-C1'-C2' 105.18 -0.837 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.584 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 O4'-C1'-C2' 107.481 1.255 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.781 0 C3'-C2'-C1' 105.356 1.897 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.826 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.406 -1.039 0 C4'-C3'-C2' 104.538 1.338 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.421 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.894 0 C3'-C2'-C1' 105.242 1.815 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.605 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.884 0 O4'-C1'-C2' 104.716 -1.258 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.605 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 101.475 -0.875 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.456 ' C8 ' ' C2 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 101.386 -0.938 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.932 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 105.106 1.719 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.932 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.619 1.0 0 P-O3'-C3' 120.67 0.808 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.556 H2'' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.928 0 C3'-C2'-C1' 100.187 -1.795 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.556 ' C6 ' H2'' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.683 1.483 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 N19-C1'-C2' 116.136 1.21 . . . . 2.14 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 100.164 -1.811 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.408 -0.219 . . . . 5.8 110.408 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -81.69 131.4 57.81 Favored Pre-proline 0 CA--C 1.514 -0.418 0 N-CA-C 109.356 -0.609 . . . . 5.35 109.356 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.91 119.16 5.9 Favored 'Trans proline' 0 N--CA 1.446 -1.266 0 C-N-CA 121.378 1.385 . . . . 2.43 110.461 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 0.76 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 0.99 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 1.51 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.67 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 0.71 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 0.68 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.4 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 1.47 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 0.77 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.37 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 0.77 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.33 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 1.32 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 1.44 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 0.77 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.38 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.08 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 2.55 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 1.63 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.38 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.61 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.7 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.1 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 1.98 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.38 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.11 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.32 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.13 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 1.75 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 0.99 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.34 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.45 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 1.45 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.87 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 0.88 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.71 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 1.47 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 0.93 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.99 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.2 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.23 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 1.88 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 0.84 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.1 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 4.72 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.618 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 0.66 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.46 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.45 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.588 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 0.78 111.117 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.08 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.66 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 4.79 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 -84.6 -28.08 26.78 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.34 111.012 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.584 ' OG ' ' HG3' ' B' ' 2' ' ' LYS . 1.7 m -107.57 73.6 0.92 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.712 -0.676 . . . . 3.86 110.556 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.413 ' H ' HD23 ' A' ' 62' ' ' LEU . 1.5 pt? . . . . . 0 C--O 1.245 0.826 0 CA-C-O 118.378 -0.82 . . . . 6.96 110.393 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.938 -0.393 . . . . 6.92 109.938 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.584 ' HG3' ' OG ' ' A' ' 61' ' ' SER . 44.6 tttm -86.4 125.32 68.02 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.996 -0.282 . . . . 6.42 111.516 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -96.0 -176.97 0.37 Allowed 'Trans proline' 0 N--CA 1.445 -1.337 0 C-N-CA 122.997 2.465 . . . . 2.1 111.696 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 1.43 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.507 ' O ' HG23 ' B' ' 9' ' ' VAL . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 0.81 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.476 ' HA ' HD23 ' B' ' 6' ' ' LEU . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 0.61 107.827 178.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 1.32 109.438 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.94 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.599 ' HA ' HD12 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.14 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 0.72 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.89 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 1.46 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.514 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 0.67 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 0.72 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.1 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.49 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.43 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 0.78 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.08 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.12 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 1.88 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.511 HG22 HG11 ' B' ' 30' ' ' VAL . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.39 109.873 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.31 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.19 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.3 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.415 ' HB2' HD21 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.08 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.25 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 1.75 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.511 HG11 HG22 ' B' ' 23' ' ' VAL . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.35 108.967 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.58 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.27 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.2 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.05 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.54 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.5 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 1.38 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.07 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 0.91 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 0.73 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.4 111.109 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.03 111.588 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 0.84 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.56 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.636 ' HA ' HG22 ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.88 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 1.6 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.439 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.09 109.849 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.39 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.83 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 0.63 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.33 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.03 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.618 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.21 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 0.99 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 89.0 38.42 6.85 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.09 112.964 178.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -100.4 3.77 43.38 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.516 -0.474 . . . . 5.92 109.748 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -103.78 101.42 11.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.437 -0.347 . . . . 4.83 110.828 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.01 74.93 8.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.719 0.295 . . . . 6.09 110.574 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.448 ' HA ' HD12 ' B' ' 62' ' ' LEU . 10.8 tp . . . . . 0 C--O 1.246 0.907 0 CA-C-N 115.768 -0.651 . . . . 7.79 111.103 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.484 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.479 -2.3 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.261 0 C3'-C2'-C1' 99.683 -2.155 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 99.813 -2.062 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.447 ' H8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.962 0 C3'-C2'-C1' 99.386 -2.367 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.441 ' C7 ' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 99.061 -2.599 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.434 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.876 -2.017 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.451 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.788 -2.08 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.451 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 99.498 -2.287 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 99.536 -2.26 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.127 -1.794 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.451 ' C6 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.87 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.484 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.713 -2.134 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.482 H2'' ' C6 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 99.815 -2.061 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.482 ' C6 ' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.205 -2.497 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.779 0 C3'-C2'-C1' 99.423 -2.341 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.921 0 C3'-C2'-C1' 99.561 -2.242 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.549 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 C3'-C2'-C1' 99.705 -2.139 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.549 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.272 -2.448 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.604 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.776 0 C3'-C2'-C1' 99.559 -2.244 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.604 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.721 -2.128 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.525 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.34 -2.4 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.525 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 C3'-C2'-C1' 99.589 -2.222 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 101.309 -0.993 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.423 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.651 -1.464 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.423 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 104.532 1.309 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.553 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C4'-C3'-C2' 104.915 1.715 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.595 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.511 1.311 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.595 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 O4'-C1'-C2' 105.395 -0.641 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.463 ' H72' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 115.724 0.952 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.402 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.752 0 O4'-C1'-C2' 104.587 -1.375 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.439 1.956 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.603 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 101.411 -0.921 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.435 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.705 2.147 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.435 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 C4'-C3'-C2' 104.251 1.051 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.588 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.122 0 C3'-C2'-C1' 105.31 1.865 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.464 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.842 0 C3'-C2'-C1' 105.224 1.803 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.229 -1.765 . . . . 0.77 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.673 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.524 0.64 0 C3'-C2'-C1' 105.75 2.179 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.673 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.624 1.442 0 P-O3'-C3' 120.581 0.734 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.679 " H1'" ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C3'-C2'-C1' 100.118 -1.844 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.679 ' C8 ' " H1'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-C3' 115.601 0.6 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 N19-C1'-C2' 116.12 1.2 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.415 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 N19-C1'-C2' 116.065 1.166 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.415 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.829 -1.337 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.251 1.051 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 mmt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 109.938 -0.393 . . . . 5.8 109.938 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -77.22 122.57 86.4 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.412 -0.358 . . . . 5.35 110.608 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -59.91 130.14 33.52 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.225 1.95 . . . . 2.43 109.699 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.03 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 0.76 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 0.99 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 1.51 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.67 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 0.71 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 0.68 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.4 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 1.47 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 0.77 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.37 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.412 HG21 ' HB ' ' A' ' 19' ' ' THR . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 0.77 116.011 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.33 110.864 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.45 ' HB2' HD12 ' A' ' 6' ' ' LEU . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 1.32 114.733 178.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.567 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.4 tp-100 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 1.44 111.457 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG21 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 0.77 111.542 -178.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' HG22 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.38 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.495 ' HB2' HD22 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.08 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 2.55 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.723 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 1.63 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.38 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.61 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.7 109.864 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.1 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 1.98 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.401 ' O ' ' C7 ' ' C' ' 4' ' ' ' DT' . 1.9 m-70 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.38 110.789 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.11 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.465 ' H ' " H3'" ' C' ' 3' ' ' ' DA' . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.32 112.597 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.13 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 1.75 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 0.99 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.34 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.45 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 1.45 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.87 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 0.88 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 0.71 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 0.93 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 0.99 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.2 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.23 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 1.88 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 0.84 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.1 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.543 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 4.72 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 0.66 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.583 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.46 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 16.4 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.45 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' C2 ' ' C' ' 11' ' ' ' DG' . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 0.78 112.888 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.08 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.66 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 4.79 110.125 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -45.61 99.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.34 112.185 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.6 p -118.0 -32.56 4.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.66 -0.7 . . . . 3.86 110.06 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.511 -0.757 . . . . 6.96 109.778 179.647 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.934 0.397 . . . . 6.92 110.666 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.429 ' HE2' ' CG1' ' B' ' 4' ' ' VAL . 80.8 tttt -124.79 96.56 40.32 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.061 -0.518 . . . . 6.42 110.494 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -87.61 87.42 0.63 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.433 2.088 . . . . 2.1 112.291 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 1.43 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.821 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 0.81 110.8 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 0.61 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 1.32 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.94 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.14 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 0.72 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.89 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.442 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 1.46 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.458 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 0.67 113.236 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 0.72 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.41 ' HB2' ' H72' ' D' ' 6' ' ' ' DT' . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.1 110.521 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.49 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.556 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.43 111.121 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 0.78 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.406 HG13 HD22 ' B' ' 6' ' ' LEU . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.08 109.639 179.085 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.592 ' HB2' ' H72' ' C' ' 14' ' ' ' DT' . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.12 108.29 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 1.88 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.39 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.31 109.3 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.19 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.3 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.08 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.25 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 1.75 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.412 HG11 ' HA ' ' B' ' 23' ' ' VAL . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.35 112.421 -179.605 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.58 109.771 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.27 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.2 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.05 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.54 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.458 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.5 112.699 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 1.38 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.07 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 0.91 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 0.73 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.4 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.03 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 0.84 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.56 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.524 ' HA ' HG22 ' B' ' 4' ' ' VAL . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.88 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 1.6 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.437 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.09 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.39 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.437 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.83 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ALA . . . . . 0.421 ' HB3' " H5'" ' C' ' 12' ' ' ' DA' . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 0.63 111.046 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.33 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.524 ' HB2' ' H ' ' B' ' 61' ' ' SER . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.03 112.171 -178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.414 HD21 " O4'" ' D' ' 12' ' ' ' DG' . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.21 110.061 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 0.99 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.34 -69.25 0.32 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.09 113.711 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.28 91.17 3.6 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.707 0.289 . . . . 5.92 111.328 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.476 ' HA ' ' HB2' ' B' ' 55' ' ' GLN . 4.6 mt-30 -61.26 128.96 38.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.106 -0.497 . . . . 4.83 110.901 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' B' ' 55' ' ' GLN . 0.7 OUTLIER -78.53 -13.13 59.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 6.09 111.137 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-N 115.458 -0.792 . . . . 7.79 110.159 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.436 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 98.974 -2.661 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.457 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.308 0 C3'-C2'-C1' 99.356 -2.389 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.457 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.465 " H3'" ' H ' ' A' ' 31' ' ' SER . . . . . . . . 0 C2'--C1' 1.506 -1.102 0 C3'-C2'-C1' 99.637 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.401 ' C7 ' ' O ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.901 0 C3'-C2'-C1' 99.03 -2.622 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.462 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.86 0 C3'-C2'-C1' 99.655 -2.175 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.567 ' H71' ' HB2' ' A' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.51 -0.771 0 C3'-C2'-C1' 99.584 -2.226 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 99.808 -2.066 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 99.274 -2.447 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.412 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.502 -1.326 0 C3'-C2'-C1' 99.88 -2.014 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.442 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.895 -2.004 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.821 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.639 -2.187 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.502 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 C3'-C2'-C1' 98.668 -2.88 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.59 -2.222 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.592 ' H72' ' HB2' ' B' ' 21' ' ' SER . . . . . . . . 0 C2'--C1' 1.51 -0.801 0 C3'-C2'-C1' 99.208 -2.494 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 C3'-C2'-C1' 99.646 -2.181 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 O4'-C1'-C2' 104.051 -1.863 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.532 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 99.207 -2.495 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.532 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.149 0 C3'-C2'-C1' 99.643 -2.184 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.852 -2.034 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-C2' 103.651 -2.227 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.762 -2.098 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.545 0 C3'-C2'-C1' 101.48 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.638 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.675 -2.161 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.638 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.494 0.567 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.56 " H5'" " H1'" ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.558 0 C3'-C2'-C1' 105.557 2.041 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.506 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 O4'-C1'-N19 108.267 0.584 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.401 H2'' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 C3'-C2'-C1' 105.138 1.741 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.556 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 N19-C1'-C2' 116.233 1.271 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.453 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.526 0.822 0 C1'-O4'-C4' 107.403 -1.641 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.75 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.925 0 C1'-O4'-C4' 107.571 -1.52 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.75 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 115.202 0.626 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.434 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.706 0 C4'-C3'-O3' 113.866 1.621 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.434 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 C4'-C3'-C2' 104.367 1.167 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.482 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.185 0 N19-C1'-C2' 116.537 1.46 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.583 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C1'-O4'-C4' 106.805 -2.068 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.401 " H5'" H2'' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.988 -1.223 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.758 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.827 0 C3'-C2'-C1' 105.605 2.075 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.758 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.36 0 C3'-C2'-C1' 101.168 -1.094 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.872 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.869 0 C3'-C2'-C1' 105.457 1.969 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.872 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.63 1.903 0 P-O3'-C3' 120.639 0.783 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.505 ' C6 ' ' H72' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 O4'-C1'-C2' 104.901 -1.09 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.505 ' H72' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 106.887 0.716 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.793 0.995 . . . . 2.14 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.762 0 C3'-C2'-C1' 101.682 -0.727 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.852 -0.425 . . . . 5.8 109.852 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -70.14 128.16 91.74 Favored Pre-proline 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 5.35 110.77 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -52.26 123.78 13.44 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.816 2.344 . . . . 2.43 112.189 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.588 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.03 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.76 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.53 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 0.99 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 1.51 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.556 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.67 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 0.71 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 0.68 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.4 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 1.47 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 0.77 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.37 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 0.77 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.33 110.332 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 1.32 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.732 HE22 ' H41' ' D' ' 15' ' ' ' DC' . 28.5 tp60 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 1.44 110.461 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 0.77 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.38 109.488 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.517 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.08 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 2.55 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 20' ' ' VAL . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 1.63 111.365 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.38 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.61 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 18.8 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.7 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.1 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 1.98 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.429 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.38 110.58 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.11 110.135 -178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.32 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.13 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 1.75 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.599 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 0.99 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.34 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.45 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 1.45 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.87 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 0.88 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 0.71 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.704 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 1.47 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 0.93 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 0.99 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.2 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.588 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.23 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 1.88 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HB3' HG11 ' A' ' 24' ' ' VAL . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 0.84 113.278 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.509 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.1 109.512 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.581 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 4.72 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.636 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 0.66 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.46 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.45 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.65 HD22 HD13 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 0.78 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.08 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.66 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 4.79 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.471 HE22 " H5'" ' C' ' 11' ' ' ' DG' . 9.5 mt-30 -112.05 -107.13 0.37 Allowed 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.34 111.267 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.75 1.76 55.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 3.86 110.922 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.131 -0.938 . . . . 6.96 110.052 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.3 mmm . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 110.199 -0.297 . . . . 6.92 110.199 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -65.01 122.78 81.48 Favored Pre-proline 0 C--O 1.237 0.416 0 N-CA-C 110.305 -0.257 . . . . 6.42 110.305 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -76.25 171.58 17.83 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.738 2.292 . . . . 2.1 113.491 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 1.43 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.593 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 0.81 111.099 -177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.499 HD22 ' CG1' ' B' ' 20' ' ' VAL . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 0.61 108.483 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 1.32 109.227 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.94 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.14 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 0.72 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.89 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 1.46 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 0.67 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 0.72 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.1 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.49 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.542 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 5.4 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.43 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 0.78 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.499 ' CG1' HD22 ' B' ' 6' ' ' LEU . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.08 109.979 178.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.12 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 1.88 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.39 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.31 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.19 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.3 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.08 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.25 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 1.75 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.35 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.58 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.27 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.2 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.05 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.614 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.54 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.5 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 1.38 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.07 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.606 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 0.91 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.73 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.4 111.717 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.03 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' GLU . . . . . 0.606 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 0.84 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.56 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.49 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.88 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 1.6 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.09 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.39 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.83 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 0.63 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.33 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.762 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.03 111.212 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.65 HD13 HD22 ' A' ' 56' ' ' LEU . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.21 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 0.99 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 117.6 24.39 3.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.09 113.786 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.762 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 4.3 mttp -117.48 98.46 6.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.555 0.693 . . . . 5.92 110.228 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -138.81 124.76 19.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.98 -1.009 . . . . 4.83 110.948 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.81 -7.08 53.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.247 -0.433 . . . . 6.09 110.264 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--O 1.246 0.875 0 CA-C-N 115.129 -0.941 . . . . 7.79 110.709 -179.902 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.53 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.206 0 C3'-C2'-C1' 99.18 -2.514 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.328 0 C3'-C2'-C1' 99.395 -2.361 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.47 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.712 0 C3'-C2'-C1' 99.354 -2.39 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.625 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C3'-C2'-C1' 98.979 -2.658 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.625 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 98.973 -2.662 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.55 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C3'-C2'-C1' 99.79 -2.078 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.591 ' H71' ' HB2' ' A' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.511 -0.727 0 C3'-C2'-C1' 99.558 -2.245 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.826 0 C3'-C2'-C1' 99.197 -2.502 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.296 0 C3'-C2'-C1' 99.64 -2.186 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 O4'-C1'-C2' 104.071 -1.845 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.537 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C3'-C2'-C1' 99.718 -2.13 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.593 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 C3'-C2'-C1' 98.976 -2.66 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.897 0 O4'-C1'-C2' 103.929 -1.973 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.015 0 C3'-C2'-C1' 99.62 -2.2 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.846 0 C3'-C2'-C1' 99.654 -2.176 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.859 0 C3'-C2'-C1' 99.877 -2.017 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.409 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.285 -2.44 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C3'-C2'-C1' 99.772 -2.092 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.604 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 O4'-C1'-C2' 103.995 -1.914 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.604 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.905 0 C3'-C2'-C1' 99.641 -2.185 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.331 -2.406 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.87 0.836 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.516 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 99.454 -2.318 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.516 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C5'-C4'-C3' 115.805 0.736 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.505 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.26 1.06 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.505 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-C2' 104.904 -1.088 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.554 " C2'" ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 102.409 -0.791 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.554 ' H72' " C2'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-C2' 107.394 1.177 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.443 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 O4'-C1'-C2' 104.869 -1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.483 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 105.431 1.951 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.531 ' C5 ' ' H73' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 C3'-C2'-C1' 101.152 -1.106 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.531 ' H73' ' C5 ' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 N19-C1'-C2' 116.204 1.253 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 N19-C1'-C2' 113.493 -0.442 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.58 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.529 1.13 0 C3'-C2'-C1' 105.391 1.922 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.509 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 P--O3' 1.598 -0.773 0 C3'-C2'-C1' 105.153 1.752 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.435 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-C2' 104.705 -1.268 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.732 ' H41' HE22 ' A' ' 18' ' ' GLN . . . . . . . . 0 P--O3' 1.614 0.544 0 O4'-C1'-C2' 107.199 0.999 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.439 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 C3'-C2'-C1' 100.443 -1.612 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.52 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 O4'-C1'-C2' 105.011 -0.99 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.05 -1.15 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 115.081 0.551 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.432 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.785 0 C4'-C3'-C2' 104.629 1.429 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.468 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.366 -1.576 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.468 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 100.165 -1.811 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 120.978 0.418 . . . . 5.8 110.978 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -90.51 134.44 30.96 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.83 -0.623 . . . . 5.35 110.294 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.96 53.38 4.41 Favored 'Trans proline' 0 CA--C 1.528 0.179 0 C-N-CA 122.924 2.416 . . . . 2.43 112.857 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.473 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.03 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 0.76 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.567 ' H ' HD23 ' A' ' 6' ' ' LEU . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 0.99 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 1.51 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.463 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.67 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 0.71 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 0.68 111.212 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.4 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 1.47 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 0.77 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.37 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 0.77 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.33 108.913 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.408 ' O ' HD12 ' A' ' 6' ' ' LEU . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 1.32 111.059 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.1 tp-100 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 1.44 110.511 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 0.77 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.38 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.08 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 2.55 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 1.63 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.38 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.61 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.7 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.1 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 1.98 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.38 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.11 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.534 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.32 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.477 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.13 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 1.75 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.534 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 0.99 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.34 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.45 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 1.45 112.339 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.87 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 0.88 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 0.71 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 1.47 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 0.93 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.99 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.2 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.23 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 1.88 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.697 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 0.84 113.667 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.1 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 4.72 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.49 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 0.66 109.833 179.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.46 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.577 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.45 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.727 HD22 HD13 ' B' ' 56' ' ' LEU . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 0.78 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.08 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.66 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 4.79 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.518 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 -48.14 141.18 6.46 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.34 114.076 -178.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.9 p -105.09 -3.22 23.37 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.804 -1.089 . . . . 3.86 111.001 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.419 ' HG ' ' OXT' ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.676 0 CA-C-O 118.574 -0.727 . . . . 6.96 110.004 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.8 ttt . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.357 0.598 . . . . 6.92 110.618 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -128.27 103.95 20.21 Favored Pre-proline 0 C--O 1.222 -0.354 0 CA-C-N 115.71 -0.677 . . . . 6.42 110.013 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -68.91 92.06 0.44 Allowed 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.697 2.265 . . . . 2.1 112.581 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' B' ' 47' ' ' TYR . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 1.43 110.974 178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.406 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 0.81 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 0.61 109.439 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 1.32 110.555 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.94 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 5' ' ' THR . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.14 110.931 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 0.72 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.89 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.426 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 1.46 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 0.67 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 0.72 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.1 112.046 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.49 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.478 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.43 111.629 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 0.78 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.08 110.823 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.12 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.686 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 1.88 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB2' ' B' ' 35' ' ' ARG . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.39 110.557 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.31 111.222 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.19 110.877 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.3 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.686 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.08 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.529 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.25 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.4 m-70 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 1.75 111.846 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.436 HG11 HG22 ' B' ' 23' ' ' VAL . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.35 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.58 110.671 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.691 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.27 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.2 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.05 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.54 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.5 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 1.38 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.07 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 0.91 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 0.73 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.4 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.03 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.426 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 0.84 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ASN . . . . . 0.532 ' OD1' HD11 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.56 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 4' ' ' VAL . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.88 109.378 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.532 HD11 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 1.6 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.4 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.09 109.137 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.39 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.83 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 0.63 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.33 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.426 ' HB2' ' H ' ' B' ' 61' ' ' SER . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.03 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 56' ' ' LEU . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.21 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 0.99 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.42 -71.0 0.03 OUTLIER Glycine 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.09 112.451 172.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 74.16 2.95 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 112.663 0.616 . . . . 5.92 112.663 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -46.46 131.54 10.88 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.679 -0.691 . . . . 4.83 110.905 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' B' ' 62' ' ' LEU . 15.6 m -132.94 108.61 9.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.676 -0.49 . . . . 6.09 109.676 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' B' ' 61' ' ' SER . 85.1 mt . . . . . 0 C--O 1.251 1.172 0 O-C-N 124.417 1.073 . . . . 7.79 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.46 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.121 -2.557 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.534 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.598 0 O4'-C1'-C2' 104.143 -1.779 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.534 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 99.278 -2.444 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.606 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.974 0 C3'-C2'-C1' 99.636 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.606 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.642 -2.184 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.488 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.462 1.422 0 O4'-C1'-C2' 103.997 -1.912 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.488 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.616 -2.203 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.437 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-C2' 103.705 -2.177 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.437 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.496 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.147 0 O4'-C1'-C2' 103.716 -2.167 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.496 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.241 0 C3'-C2'-C1' 100.046 -1.896 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.678 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 P--O3' 1.628 1.72 0 C3'-C2'-C1' 99.918 -1.987 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.011 0 C3'-C2'-C1' 98.903 -2.712 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.673 0 C3'-C2'-C1' 99.389 -2.365 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.561 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.768 -2.094 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.561 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.911 0 C3'-C2'-C1' 99.381 -2.371 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.45 -2.321 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.61 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.88 0 C3'-C2'-C1' 99.746 -2.11 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.61 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.791 -2.792 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 O4'-C1'-C2' 104.067 -1.848 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.621 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 99.606 -2.21 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.621 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.971 0 C3'-C2'-C1' 98.723 -2.84 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.4 ' H8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.235 0 C3'-C2'-C1' 99.48 -2.3 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 116.07 1.169 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.485 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.519 0.998 0 C3'-C2'-C1' 98.911 -2.707 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.485 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.11 0 C3'-C2'-C1' 100.923 -1.269 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.646 H2'' ' H71' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 100.04 -1.9 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.646 ' H71' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.991 0 O4'-C1'-N19 108.899 1.374 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.608 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.13 0 C3'-C2'-C1' 105.205 1.789 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.608 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.532 0.81 0 C3'-C2'-C1' 105.988 2.349 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.532 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.89 -1.1 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.042 0 C3'-C2'-C1' 105.51 2.007 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.481 ' C6 ' " H2'" ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.417 -1.439 0 C1'-O4'-C4' 110.427 0.52 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.65 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.419 -1.317 0 C3'-C2'-C1' 99.306 -2.424 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.65 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.536 0.785 0 C4'-C3'-C2' 104.902 1.702 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.565 " H4'" HD22 ' A' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.872 1.045 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.697 ' OP1' ' HA ' ' A' ' 49' ' ' PRO . . . . . . . . 0 O4'--C1' 1.399 -1.591 0 C1'-O4'-C4' 106.902 -1.998 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.507 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 O4'-C1'-C2' 104.884 -1.105 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.634 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.877 0 C3'-C2'-C1' 106.081 2.415 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.634 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.317 0 C3'-C2'-C1' 104.841 1.529 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.46 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 105.043 -0.961 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.025 0 O4'-C4'-C3' 106.372 0.772 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.579 ' C6 ' ' H72' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.757 0.973 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.579 ' H72' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-N19 108.291 0.613 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.498 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.897 -2.002 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.42 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.497 1.297 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptt? . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.423 -0.214 . . . . 5.8 110.423 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt 62.9 96.16 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.327 0 C-N-CA 123.118 0.567 . . . . 5.35 111.377 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.17 176.7 5.99 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.523 2.149 . . . . 2.43 112.859 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.03 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 0.76 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 20' ' ' VAL . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 0.99 111.591 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 1.51 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.67 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 0.71 110.225 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 0.68 111.752 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.4 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 1.47 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 0.77 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.37 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 0.77 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.33 109.393 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.402 ' O ' HD13 ' A' ' 6' ' ' LEU . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 1.32 111.075 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 1.44 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 0.77 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.496 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.38 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.08 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 2.55 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 1.63 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.38 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.61 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.7 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.1 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 1.98 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.38 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.32 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.13 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 1.75 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.604 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 0.99 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.34 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.45 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 1.45 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.87 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 0.88 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 0.71 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 1.47 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 0.93 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 0.99 111.45 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.2 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.23 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.439 HD13 ' HA ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 1.88 108.608 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 0.84 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.488 HD22 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.1 109.379 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 4.72 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.565 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 0.66 110.002 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.549 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.46 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.45 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.638 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 0.78 112.135 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.08 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.66 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 4.79 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER 88.92 -12.19 0.41 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.34 111.853 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.16 10.34 36.27 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.323 0.583 . . . . 3.86 110.634 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-N 115.533 -0.758 . . . . 6.96 111.53 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 109.416 -0.587 . . . . 6.92 109.416 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 42.6 mtmt -76.68 118.82 74.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.669 -0.241 . . . . 6.42 110.809 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.56 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo -83.98 -5.63 10.48 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.986 1.791 . . . . 2.1 112.142 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' B' ' 47' ' ' TYR . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 1.43 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.639 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 0.81 110.091 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.612 HD22 HG11 ' B' ' 20' ' ' VAL . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 0.61 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 1.32 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.94 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.14 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.72 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.89 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 1.46 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 0.67 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 0.72 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.1 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.49 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.693 ' HB2' ' H73' ' D' ' 6' ' ' ' DT' . 10.1 tp60 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.43 112.228 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.506 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 0.78 110.893 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.612 HG11 HD22 ' B' ' 6' ' ' LEU . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.08 110.016 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.12 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' HE21 ' B' ' 18' ' ' GLN . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 1.88 110.495 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' B' ' 35' ' ' ARG . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.39 109.849 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.31 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.19 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.3 110.972 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.08 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.25 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 1.75 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 23' ' ' VAL . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.35 111.351 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.421 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.58 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.27 109.442 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.2 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.05 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.576 ' HA ' HG21 ' B' ' 23' ' ' VAL . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.54 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.5 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 1.38 112.599 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.07 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 0.91 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.73 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.4 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.03 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 0.84 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.56 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.546 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.88 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 1.6 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.497 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.429 ' H ' HG22 ' B' ' 48' ' ' ILE . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.09 110.044 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.39 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.83 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 0.63 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.33 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.61 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.03 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.673 HD21 " O4'" ' D' ' 12' ' ' ' DG' . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.21 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 0.99 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 94.08 28.1 11.35 Favored Glycine 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.09 113.668 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -125.57 21.35 7.8 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.072 -0.714 . . . . 5.92 109.072 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -65.63 126.53 28.67 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.62 -0.718 . . . . 4.83 110.128 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 20.4 m -146.91 53.82 1.09 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.34 -0.845 . . . . 6.09 110.092 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 tp . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.677 -0.692 . . . . 7.79 109.649 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.5 -1.465 0 C3'-C2'-C1' 98.929 -2.693 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.441 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.053 0 C3'-C2'-C1' 99.704 -2.14 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.441 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.619 0.987 0 C3'-C2'-C1' 99.877 -2.016 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.582 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.597 -2.217 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.582 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 C3'-C2'-C1' 99.131 -2.549 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.48 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 O4'-C1'-C2' 103.738 -2.147 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.48 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.144 0 C3'-C2'-C1' 99.567 -2.238 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.411 ' H8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 C3'-C2'-C1' 99.35 -2.393 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 C3'-C2'-C1' 99.185 -2.511 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.301 0 C3'-C2'-C1' 99.788 -2.08 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.117 0 O4'-C1'-C2' 103.972 -1.935 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.505 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 100.225 -1.768 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.639 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.418 ' C6 ' ' C2 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 C3'-C2'-C1' 99.677 -2.159 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.713 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.806 0 C3'-C2'-C1' 99.361 -2.385 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.713 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 99.677 -2.16 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 99.47 -2.307 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.576 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.81 -2.064 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.943 0 C3'-C2'-C1' 99.138 -2.544 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.597 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 C3'-C2'-C1' 99.49 -2.293 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 100.074 -1.876 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 99.403 -2.355 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 99.253 -2.462 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 N19-C1'-C2' 116.261 1.288 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.741 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 C3'-C2'-C1' 99.058 -2.601 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.741 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C4'-C3'-C2' 101.881 -1.319 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.581 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 100.485 -1.582 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.581 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.821 0 C3'-C2'-C1' 105.141 1.743 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.514 ' N7 ' ' HG2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.693 ' H73' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 105.474 1.982 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.613 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.041 0 C3'-C2'-C1' 100.645 -1.468 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.613 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.866 0 O3'-P-O5' 102.746 -0.66 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.501 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 N19-C1'-C2' 116.352 1.345 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.657 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C4'-C3'-C2' 101.778 -1.422 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.657 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 102.048 -0.465 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.673 " O4'" HD21 ' B' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.526 0.772 0 C3'-C2'-C1' 105.265 1.832 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.67 " H2'" ' H71' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 105.202 1.787 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.67 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 O4'-C4'-C3' 106.339 0.739 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 101.396 -0.931 . . . . 1.14 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.408 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.728 0 C3'-C2'-C1' 101.239 -1.043 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.408 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.673 -0.734 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C4'-C3'-C2' 104.093 0.893 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.529 " H2'" ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.849 0 C3'-C2'-C1' 101.011 -1.206 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.529 ' H71' " H2'" ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.782 0 C4'-C3'-C2' 104.364 1.164 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.527 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.407 -1.638 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.512 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 N19-C1'-C2' 115.377 0.736 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 110.643 -0.132 . . . . 5.8 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' CB ' ' A' ' 46' ' ' ASN . 47.4 mtpt -132.12 144.91 55.11 Favored Pre-proline 0 N--CA 1.468 0.429 0 N-CA-C 110.32 -0.252 . . . . 5.35 110.32 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -70.33 61.12 2.03 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.488 2.125 . . . . 2.43 113.271 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.03 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 0.76 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.548 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 0.99 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 1.51 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.67 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 0.71 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.58 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 0.68 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.4 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 1.47 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 0.77 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.37 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 0.77 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.58 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.33 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.548 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 1.32 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.478 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 6.3 tp-100 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 1.44 110.501 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 0.77 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.421 HG12 HG13 ' A' ' 38' ' ' VAL . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.38 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.08 111.995 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 2.55 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 1.63 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.38 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.61 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.7 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 1.98 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.38 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.11 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.32 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.13 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 1.75 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 0.99 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HE ' ' HG3' ' A' ' 36' ' ' GLU . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.34 110.016 178.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' HG3' ' HE ' ' A' ' 35' ' ' ARG . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.45 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 1.45 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.87 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 0.88 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.71 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 1.47 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 0.93 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 0.99 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.451 ' CB ' ' HD3' ' A' ' 2' ' ' LYS . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.2 110.3 -178.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.23 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 1.88 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 0.84 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.1 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.46 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 4.72 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.592 ' CA ' HD11 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.66 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.46 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.59 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.45 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.778 HD21 ' C2 ' ' C' ' 11' ' ' ' DG' . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 0.78 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.08 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.66 113.245 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 4.79 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 -36.11 115.69 0.35 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.34 114.015 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.58 33.0 4.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.76 -0.654 . . . . 3.86 109.705 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.059 -0.972 . . . . 6.96 109.949 -179.005 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.166 -0.309 . . . . 6.92 110.166 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.427 ' HB3' ' HD3' ' B' ' 3' ' ' PRO . 11.3 tptm -168.28 -50.41 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.882 -0.58 . . . . 6.42 111.957 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' B' ' 2' ' ' LYS . 44.9 Cg_exo -56.62 100.57 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 122.079 1.853 . . . . 2.1 112.414 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 1.43 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.617 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 0.81 110.617 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' B' ' 6' ' ' LEU . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 0.61 107.61 177.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 1.32 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.94 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.14 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 0.72 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.89 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 1.46 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.538 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 0.67 113.89 -177.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 0.72 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.1 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.49 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.696 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.43 110.975 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 0.78 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.08 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.12 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.402 ' CZ ' ' H73' ' D' ' 4' ' ' ' DT' . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 1.88 110.348 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.501 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.39 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.31 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.19 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.472 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.3 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.472 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.08 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.408 ' H ' ' HB1' ' B' ' 27' ' ' ALA . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.25 114.186 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 1.75 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.501 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.35 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.542 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.58 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.27 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.2 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.542 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.05 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.54 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.5 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.538 ' HA ' ' HB2' ' B' ' 13' ' ' ALA . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 1.38 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.07 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 0.91 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 0.73 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.4 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.03 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 0.84 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ASN . . . . . 0.415 HD22 ' HE2' ' B' ' 2' ' ' LYS . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.56 112.233 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.568 ' HA ' HG22 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.88 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 1.6 108.332 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.445 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.586 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.09 108.907 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.39 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.83 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ALA . . . . . 0.586 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 0.63 109.969 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.33 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.03 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.592 HD11 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.21 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 0.99 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLY . . . . . 0.529 ' O ' ' HG3' ' B' ' 59' ' ' LYS . . . 99.36 104.7 2.56 Favored Glycine 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.09 109.099 -176.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.529 ' HG3' ' O ' ' B' ' 58' ' ' GLY . 11.3 mtpp 171.95 -38.1 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.791 1.236 . . . . 5.92 109.664 -178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -149.33 39.36 0.82 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.145 -1.057 . . . . 4.83 108.145 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -69.63 100.26 1.43 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.761 -0.654 . . . . 6.09 111.152 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.527 -0.749 . . . . 7.79 111.348 -179.835 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 C3'-C2'-C1' 99.546 -2.253 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.542 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.058 0 C3'-C2'-C1' 99.196 -2.503 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.542 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.543 0 O4'-C1'-C2' 103.863 -2.033 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.429 ' H8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.466 -2.31 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 98.574 -2.947 . . . . 1.18 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.534 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 C3'-C2'-C1' 100.036 -1.903 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.534 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.868 0 C3'-C2'-C1' 99.499 -2.287 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.078 0 C3'-C2'-C1' 99.225 -2.482 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 99.453 -2.32 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.564 0 C3'-C2'-C1' 99.552 -2.248 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.716 -2.132 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.778 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 100.073 -1.877 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.548 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 98.873 -2.733 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.519 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.842 0 O4'-C1'-C2' 103.797 -2.094 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.519 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.459 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.983 0 O4'-C1'-C2' 103.996 -1.912 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . 0.417 H2'' ' C5 ' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.721 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.63 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.453 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.201 0 C3'-C2'-C1' 99.806 -2.067 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.566 " H1'" ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.566 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 99.303 -2.426 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.513 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.109 0 C3'-C2'-C1' 99.927 -1.981 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.513 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.404 ' C8 ' " H1'" ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 C3'-C2'-C1' 99.241 -2.47 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.245 -1.753 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.692 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 100.153 -1.819 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.692 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O4'-C1'-C2' 107.206 1.006 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.498 " H2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.806 0 C3'-C2'-C1' 105.619 2.085 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.498 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C4'-C3'-C2' 104.374 1.174 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.709 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.756 0 C3'-C2'-C1' 105.135 1.739 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.709 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.554 1.354 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 105.572 2.052 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C3'-C2'-C1' 100.31 -1.707 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-O3' 113.998 1.681 . . . . 1.41 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.44 1.24 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.558 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.53 1.177 0 C3'-C2'-C1' 104.752 1.466 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.546 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 104.93 1.593 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.78 0 N19-C1'-C2' 116.14 1.212 . . . . 0.77 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.858 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 106.669 2.835 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.858 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.716 0 C3'-C2'-C1' 101.325 -0.982 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.42 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.583 0 N19-C1'-C2' 115.585 0.866 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.417 ' H8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 106.855 0.687 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.411 ' C4 ' ' C5 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 N19-C1'-C2' 115.36 0.725 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.639 H2'' ' H71' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.718 0 O4'-C1'-C2' 104.721 -1.254 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.639 ' H71' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 N19-C1'-C2' 115.205 0.628 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-C2' 105.372 -0.662 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 ttp . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.915 0.388 . . . . 5.8 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.484 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 34.7 mttm -85.53 136.6 37.11 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 116.072 -0.513 . . . . 5.35 111.04 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 5.8 Cg_exo -75.94 100.18 1.35 Allowed 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.838 2.359 . . . . 2.43 111.606 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.405 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.03 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 0.76 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.511 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 0.99 112.311 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 1.51 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.67 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 0.71 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 0.68 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.4 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 1.47 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 0.77 112.96 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.37 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 0.77 109.956 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.33 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB2' HD13 ' A' ' 6' ' ' LEU . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 1.32 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 1.44 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 0.77 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.451 HG12 ' HB ' ' A' ' 38' ' ' VAL . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.38 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.08 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.408 ' CZ ' ' H73' ' C' ' 4' ' ' ' DT' . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 2.55 111.233 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 35' ' ' ARG . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 1.63 109.984 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.4 HG12 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.38 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.61 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.598 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.7 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.1 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 1.98 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.38 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.11 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.32 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.13 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 1.75 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 0.99 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.34 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.45 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.451 ' HB ' HG12 ' A' ' 20' ' ' VAL . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 1.45 111.971 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.87 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 0.88 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 0.71 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 1.47 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 0.93 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 0.99 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.2 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.23 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 1.88 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 0.84 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.1 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 4.72 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 0.66 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.417 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.46 112.441 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.45 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.69 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 0.78 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.08 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.66 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 4.79 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -104.4 9.73 35.61 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.34 111.111 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.552 ' OG ' ' HA ' ' B' ' 1' ' ' MET . 18.5 m -104.73 70.28 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.318 0.58 . . . . 3.86 110.14 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 C--O 1.246 0.9 0 CA-C-N 115.386 -0.825 . . . . 6.96 109.725 -179.801 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.552 ' HA ' ' OG ' ' A' ' 61' ' ' SER . 39.6 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.735 0.302 . . . . 6.92 110.711 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -109.51 102.04 48.25 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 6.42 109.923 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -86.87 -158.26 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.967 2.445 . . . . 2.1 112.951 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 1.43 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.505 ' O ' HG23 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 0.81 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 0.61 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 1.32 109.548 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.94 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.14 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 0.72 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.89 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.455 ' CD1' ' HB2' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 1.46 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 0.67 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.493 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 0.72 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.1 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.49 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.617 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.43 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 0.78 111.774 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.447 ' CG1' HD22 ' B' ' 6' ' ' LEU . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.08 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.546 ' O ' HG12 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.12 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 1.88 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.39 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.546 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.31 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.19 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.557 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.3 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.557 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.08 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.25 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 1.75 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.35 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.58 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.711 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.27 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.2 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.05 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.54 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.5 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.493 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 1.38 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' B' ' 42' ' ' MET . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.07 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 0.91 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.455 ' HB2' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.73 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.594 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.4 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.03 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 0.84 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.56 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.588 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.88 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 1.6 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.09 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' B' ' 62' ' ' LEU . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.39 110.44 -178.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.83 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 0.63 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.33 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.798 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.03 112.262 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 0.99 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.24 -2.44 16.45 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.09 113.792 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.798 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 58.7 mmtt -96.44 85.61 3.96 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.159 -0.682 . . . . 5.92 109.159 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -83.74 56.77 3.78 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.233 0.539 . . . . 4.83 111.244 -177.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.85 -15.96 23.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.582 -0.736 . . . . 6.09 110.469 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' B' ' 62' ' ' LEU . 2.1 mm? . . . . . 0 C--O 1.249 1.026 0 CA-C-O 117.767 -1.111 . . . . 7.79 110.182 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.51 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.582 -2.227 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.51 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.255 0 C3'-C2'-C1' 99.679 -2.158 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C1'-C2' 103.807 -2.084 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.648 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 99.076 -2.589 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.648 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.281 -2.442 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.442 ' C8 ' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-C2' 103.889 -2.01 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 C3'-C2'-C1' 99.027 -2.624 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.519 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.086 0 C3'-C2'-C1' 99.028 -2.623 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.505 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.823 0 C3'-C2'-C1' 99.652 -2.177 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.419 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 O4'-C1'-C2' 103.932 -1.971 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.564 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 103.797 -2.094 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.564 ' C8 ' H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.495 ' N7 ' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.068 0 C3'-C2'-C1' 99.005 -2.64 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.418 H2'' ' C6 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.135 0 C3'-C2'-C1' 99.85 -2.036 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.418 ' C6 ' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.314 -2.418 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.452 -2.32 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.912 0 C3'-C2'-C1' 99.823 -2.055 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.423 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.519 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 98.711 -2.85 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.519 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 C3'-C2'-C1' 99.634 -2.19 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.454 ' C4 ' ' C5 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.583 -2.227 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.459 ' C2 ' ' C5 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.459 ' C5 ' ' C2 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.092 0 C3'-C2'-C1' 99.437 -2.331 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O5'-P-OP1 106.798 -0.449 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.456 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C3'-C2'-C1' 99.594 -2.219 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.734 0 C4'-C3'-C2' 102.619 -0.581 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.584 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.731 -1.406 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.584 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.726 0 O4'-C1'-C2' 105.098 -0.911 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.539 H2'' ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 101.894 -0.576 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.617 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 N19-C1'-C2' 115.674 0.921 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.004 0 C1'-O4'-C4' 106.821 -2.056 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.601 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.55 2.036 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.601 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 100.702 -1.427 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.443 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.059 -2.601 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.479 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 101.952 -0.534 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.69 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.508 -0.893 0 C4'-C3'-C2' 104.648 1.448 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.54 " H2'" ' H71' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.439 -0.642 0 C1'-O4'-C4' 106.843 -2.041 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.54 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-C2' 105.157 -0.858 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.64 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.525 0.684 0 C3'-C2'-C1' 106.251 2.536 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.64 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C4'-C3'-C2' 103.934 0.734 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.803 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.441 0.774 0 C3'-C2'-C1' 105.273 1.838 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.803 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.631 1.967 0 C3'-C2'-C1' 104.916 1.583 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.143 -1.112 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C1'-O4'-C4' 107.321 -1.7 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.572 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C3'-C2'-C1' 100.205 -1.782 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C5'-C4'-O4' 108.204 -0.748 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 tpt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.935 0.398 . . . . 5.8 111.194 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 37.7 mmtt -124.17 125.56 25.72 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.608 -0.269 . . . . 5.35 110.402 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 7.5 Cg_exo -70.06 98.37 0.71 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.106 1.871 . . . . 2.43 110.666 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.429 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.03 109.987 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 0.76 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.607 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 0.99 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 1.51 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.429 ' HB2' HG12 ' A' ' 4' ' ' VAL . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.67 109.735 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 0.71 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 0.68 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.4 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 1.47 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 0.77 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.37 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 0.77 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.33 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.607 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 1.32 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 1.44 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 0.77 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.435 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.38 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.08 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HD3' HG23 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 2.55 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.607 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 1.63 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.38 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.515 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.61 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.515 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.7 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.1 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 1.98 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.38 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.472 HG23 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.11 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.426 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.32 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.13 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 1.75 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 0.99 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.34 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.45 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.435 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 1.45 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.87 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 0.88 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 0.71 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 1.47 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 0.93 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 0.99 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.2 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.23 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 1.88 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 0.84 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.1 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.464 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 4.72 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 0.66 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.522 ' HG2' ' OP1' ' D' ' 14' ' ' ' DT' . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.46 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.45 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' B' ' 56' ' ' LEU . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 0.78 113.506 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.08 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.66 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.511 ' HZ2' " C3'" ' D' ' 14' ' ' ' DT' . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 4.79 112.589 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.633 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER 64.73 -167.35 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.34 110.191 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 -47.84 13.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.571 0.224 . . . . 3.86 110.776 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.586 -0.721 . . . . 6.96 110.212 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.895 0.379 . . . . 6.92 111.252 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -77.82 140.07 62.65 Favored Pre-proline 0 N--CA 1.45 -0.432 0 CA-C-N 115.997 -0.547 . . . . 6.42 111.023 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 154.41 47.26 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.725 2.284 . . . . 2.1 112.814 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 1.43 109.77 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 0.81 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.489 HD22 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 0.61 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 1.32 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.94 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.14 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.634 ' HB2' HG21 ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 0.72 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.89 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 1.46 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.45 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 0.67 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.459 HG21 HG22 ' B' ' 38' ' ' VAL . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 0.72 109.506 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.456 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.1 110.671 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.49 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.516 ' CB ' ' H73' ' D' ' 6' ' ' ' DT' . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.43 109.456 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 0.78 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.634 HG21 ' HB2' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.08 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.648 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.12 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 1.88 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 38' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.39 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.31 107.32 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.648 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.19 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.3 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.08 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.25 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 1.75 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.4 ' HA ' ' OP1' ' D' ' 4' ' ' ' DT' . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.35 114.032 -179.214 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.58 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.27 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.2 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.451 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.05 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.54 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.5 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 23' ' ' VAL . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 1.38 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.07 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 0.91 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 0.73 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.4 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.03 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 0.84 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.56 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.88 112.046 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 1.6 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.09 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.612 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.39 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.83 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 0.63 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.33 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.612 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.03 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' A' ' 56' ' ' LEU . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.21 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 0.99 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -146.05 -97.79 0.22 Allowed Glycine 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.09 110.107 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -145.95 6.61 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.581 0.215 . . . . 5.92 111.581 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.85 113.68 26.02 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.401 0.62 . . . . 4.83 111.633 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -66.85 -44.44 81.02 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.063 -0.972 . . . . 6.09 110.494 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.11 -0.947 . . . . 7.79 110.157 -179.678 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.601 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.83 0 C3'-C2'-C1' 99.314 -2.419 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.119 0 C3'-C2'-C1' 99.73 -2.121 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.406 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.663 0 C3'-C2'-C1' 99.696 -2.146 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.48 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.9 0 C3'-C2'-C1' 99.917 -1.988 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.48 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.06 0 C3'-C2'-C1' 99.394 -2.362 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.479 H2'' ' C6 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.815 0 C3'-C2'-C1' 99.509 -2.279 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.479 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.029 0 C3'-C2'-C1' 98.861 -2.742 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.42 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.42 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.595 H2'' ' C5 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.503 -1.316 0 O4'-C1'-C2' 104.038 -1.875 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.595 ' C5 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.955 -1.95 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.568 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 C3'-C2'-C1' 100.24 -1.757 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.568 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.047 0 C3'-C2'-C1' 99.168 -2.523 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.752 0 O4'-C1'-C2' 103.691 -2.19 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.499 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.063 0 C3'-C2'-C1' 99.251 -2.463 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.956 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.459 -2.315 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.435 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.887 0 C3'-C2'-C1' 99.725 -2.125 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.522 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.99 -2.65 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.175 -2.518 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.642 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.182 0 C3'-C2'-C1' 99.97 -1.95 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.642 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.297 -2.431 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.033 0 C3'-C2'-C1' 99.51 -2.279 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.329 0.705 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.515 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 99.789 -2.079 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.515 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C2'-C3'-O3' 112.397 0.665 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.567 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 105.385 1.918 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.567 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 OP2-P-O3' 110.137 0.574 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 104.641 1.386 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.614 ' C6 ' ' H72' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.828 1.52 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.614 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C1'-O4'-C4' 107.369 -1.665 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.46 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 105.37 1.907 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.555 ' C6 ' ' H72' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 N19-C1'-C2' 115.134 0.584 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.555 ' H72' ' C6 ' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 105.297 1.855 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.536 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.453 1.253 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.103 1.189 . . . . 1.19 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.487 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.406 -1.04 0 C1'-O4'-C4' 106.607 -2.21 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.522 ' OP1' ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 C2'--C1' 1.507 -1.006 0 C1'-O4'-C4' 107.656 -1.46 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.513 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O3'-P-O5' 102.594 -0.74 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.443 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.926 -1.267 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.484 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C4'-C3'-C2' 105.091 1.891 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.484 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.618 0.953 0 C5'-C4'-C3' 116.284 1.056 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.449 ' OP2' H2'' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 O4'-C1'-C2' 104.88 -1.109 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.45 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 106.083 0.483 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.45 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C3'-C2'-C1' 99.807 -2.066 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.435 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 N19-C1'-C2' 116.11 1.194 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.532 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 73.4 mtp . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.074 0.464 . . . . 5.8 110.331 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 45' ' ' LEU . 58.9 mtpt -122.11 145.81 44.92 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.724 -0.472 . . . . 5.35 109.724 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -80.79 58.86 7.22 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.182 1.922 . . . . 2.43 111.913 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.03 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 0.76 110.614 178.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 0.99 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 1.51 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.67 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' THR . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 0.71 109.588 177.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 0.68 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.4 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 1.47 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 0.77 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.37 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 0.77 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.33 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.451 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 1.32 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.631 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 25.1 tp60 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 1.44 109.972 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 0.77 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 24' ' ' VAL . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.38 111.223 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.08 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HE ' HG23 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 2.55 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.624 ' HB ' HG11 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 1.63 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.38 109.947 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.61 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.7 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.1 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 1.98 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.38 109.216 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG23 ' HE ' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.11 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.432 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.32 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.13 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 1.75 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 0.99 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 35' ' ' ARG . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.34 110.843 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.45 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.624 HG11 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 1.45 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' MET . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.87 111.237 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 0.88 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 0.71 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' GLU . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 1.47 111.11 -178.316 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 0.93 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.437 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 0.99 110.71 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.532 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.2 110.512 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.23 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.427 HD12 ' HD2' ' A' ' 49' ' ' PRO . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 1.88 109.882 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 48' ' ' ILE . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 0.84 113.453 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.1 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 4.72 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.537 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 0.66 109.242 178.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.46 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.45 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' B' ' 56' ' ' LEU . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 0.78 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.08 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.66 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 4.79 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.54 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 0.2 OUTLIER 66.0 81.39 0.2 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.34 110.212 179.284 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.4 m -110.42 111.91 23.49 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.935 -0.395 . . . . 3.86 109.935 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.608 0 CA-C-O 118.124 -0.941 . . . . 6.96 110.546 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.6 mmt . . . . . 0 N--CA 1.483 1.178 0 CA-C-O 120.951 0.405 . . . . 6.92 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -83.5 160.41 59.26 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 116.359 -0.382 . . . . 6.42 110.073 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.04 94.24 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.93 2.42 . . . . 2.1 112.291 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 1.43 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 0.81 111.842 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' B' ' 6' ' ' LEU . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 0.61 108.725 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 1.32 109.941 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.94 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.14 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 0.72 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.89 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 1.46 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 0.67 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 0.72 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.1 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.49 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.67 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.43 111.299 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 0.78 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.08 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.12 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.49 ' CZ ' ' H72' ' D' ' 4' ' ' ' DT' . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 1.88 110.279 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.39 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.31 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.19 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.3 111.241 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.08 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.25 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 1.75 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.35 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.58 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.27 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.2 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.05 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.54 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.5 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 1.38 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.07 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 0.91 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 0.73 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.4 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.03 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 0.84 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.56 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.88 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 1.6 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.466 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.09 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.39 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.83 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.63 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.33 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.03 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' A' ' 56' ' ' LEU . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.21 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 0.99 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.18 -90.13 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.09 111.539 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' B' ' 59' ' ' LYS . 24.8 mtpp -150.8 -91.18 0.06 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.534 0.683 . . . . 5.92 110.491 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -122.15 70.01 0.96 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.163 -0.926 . . . . 4.83 110.399 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.48 103.31 15.23 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.496 -0.557 . . . . 6.09 109.496 179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.243 0.753 0 CA-C-O 118.313 -0.851 . . . . 7.79 110.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 99.659 -2.172 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.191 0 O4'-C1'-C2' 103.582 -2.289 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.464 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.93 0 C3'-C2'-C1' 99.539 -2.258 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.511 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 99.156 -2.531 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.511 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 98.801 -2.785 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.632 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 99.478 -2.301 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.632 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.73 0 C3'-C2'-C1' 99.364 -2.383 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.549 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 99.541 -2.257 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.813 0 C3'-C2'-C1' 99.007 -2.638 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.573 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 O4'-C1'-C2' 103.796 -2.095 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.531 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.252 0 C3'-C2'-C1' 99.514 -2.276 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.531 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.269 0 C3'-C2'-C1' 99.105 -2.568 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 C3'-C2'-C1' 100.027 -1.909 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 C3'-C2'-C1' 99.329 -2.408 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 99.608 -2.208 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 100.072 -1.877 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.565 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 99.415 -2.347 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.472 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 C3'-C2'-C1' 99.271 -2.449 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.449 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.84 0 C3'-C2'-C1' 99.424 -2.34 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.453 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.275 -2.446 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.453 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.876 0 C3'-C2'-C1' 99.451 -2.321 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . 0.512 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.437 0.474 0 O4'-C4'-C3' 106.672 1.072 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.512 ' C8 ' H2'' ' D' ' -1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.62 1.122 0 C3'-C2'-C1' 98.02 -3.343 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.404 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C5'-C4'-C3' 116.356 1.104 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.632 " H2'" ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C3'-C2'-C1' 105.532 2.023 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.632 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C4'-C3'-C2' 104.505 1.305 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 N19-C1'-C2' 115.575 0.86 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.67 ' H73' ' HB3' ' B' ' 18' ' ' GLN . . . . . . . . 0 P--O3' 1.617 0.875 0 C3'-C2'-C1' 105.673 2.124 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.587 " O5'" H2'' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.007 0 C1'-O4'-C4' 107.83 -1.336 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 100.96 -1.243 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.449 H2'' ' OP2' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 104.908 1.577 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.579 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.422 -1.118 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.579 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.146 0 P-O3'-C3' 120.779 0.899 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.792 " H1'" " O4'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.529 1.068 0 C3'-C2'-C1' 105.203 1.788 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.792 " O4'" " H1'" ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.403 -1.321 0 C1'-O4'-C4' 106.016 -2.632 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.585 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.528 0.976 0 O4'-C1'-C2' 104.782 -1.198 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.646 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.312 1.866 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.552 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.423 -1.065 0 C3'-C2'-C1' 100.994 -1.218 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.552 ' C5 ' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 N19-C1'-C2' 115.405 0.753 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.864 0 O4'-C4'-C3' 106.327 0.727 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 N19-C1'-C2' 116.091 1.182 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.055 0 C1'-O4'-C4' 107.574 -1.519 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.614 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 99.737 -2.117 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.614 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.163 0 C1'-O4'-C4' 107.307 -1.709 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.027 -0.36 . . . . 5.8 110.027 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 106.33 57.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.362 -0.381 . . . . 5.35 110.036 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.87 134.81 45.12 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.68 2.253 . . . . 2.43 111.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.563 HG12 ' HB2' ' A' ' 8' ' ' ASP . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.03 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 0.76 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.493 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 0.99 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 1.51 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.563 ' HB2' HG12 ' A' ' 4' ' ' VAL . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.67 109.385 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 0.71 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 0.68 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.4 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 1.47 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 0.77 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.37 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 0.77 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.33 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.493 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 1.32 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 4.4 tp-100 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 1.44 110.254 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 0.77 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.505 ' O ' HG23 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.38 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.08 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 2.55 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.444 HG21 ' CG2' ' A' ' 38' ' ' VAL . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 1.63 110.527 -178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.38 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.414 HD21 ' P ' ' D' ' 14' ' ' ' DT' . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.61 109.874 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.7 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.1 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 1.98 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.38 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.11 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.32 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.13 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 1.75 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 0.99 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.34 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.45 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.444 ' CG2' HG21 ' A' ' 23' ' ' VAL . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 1.45 110.899 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.87 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 0.88 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 0.71 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 1.47 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 0.93 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HB3' HG11 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 0.99 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.2 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.23 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 1.88 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 0.84 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.1 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 4.72 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 0.66 110.096 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.46 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.45 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.597 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 0.78 112.076 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.08 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.66 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.569 ' O ' HD23 ' A' ' 62' ' ' LEU . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 4.79 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -45.73 -54.04 8.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.34 111.918 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.0 m -134.92 66.8 1.52 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.734 -0.469 . . . . 3.86 109.734 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 59' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.399 -0.81 . . . . 6.96 111.168 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 110.217 -0.29 . . . . 6.92 110.217 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -150.34 104.81 3.12 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.593 -0.276 . . . . 6.42 110.507 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -87.9 -159.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.753 2.302 . . . . 2.1 111.175 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 1.43 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.65 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 0.81 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 6' ' ' LEU . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.61 109.92 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 1.32 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.94 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.14 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 0.72 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.89 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 1.46 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 0.67 112.429 -178.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 0.72 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.425 ' HB2' ' OG1' ' B' ' 19' ' ' THR . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.1 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.43 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.49 112.8 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.478 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.43 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 0.78 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.08 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.422 ' OG ' ' H73' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.12 110.66 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 1.88 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.573 HG22 HG11 ' B' ' 30' ' ' VAL . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.39 110.537 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.31 112.682 -178.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.457 ' CG ' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.19 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.457 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.3 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.08 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.25 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 1.75 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.573 HG11 HG22 ' B' ' 23' ' ' VAL . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.35 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.499 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.58 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.27 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.2 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.05 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.54 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.5 111.943 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 1.38 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.07 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.91 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 0.73 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.4 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.03 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.84 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.56 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.88 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.404 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 1.6 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.09 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.39 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.83 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 0.63 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.33 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.03 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.21 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 0.99 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 70.54 49.34 31.43 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.09 114.447 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -83.15 -44.42 15.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.989 0.395 . . . . 5.92 110.413 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -95.11 111.95 23.71 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.14 -0.689 . . . . 4.83 109.14 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 26.2 m -77.0 -20.14 56.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.55 -0.295 . . . . 6.09 111.699 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--O 1.254 1.299 0 CA-C-O 118.226 -0.892 . . . . 7.79 111.456 178.914 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.446 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 99.383 -2.369 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.465 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.11 0 C3'-C2'-C1' 99.406 -2.353 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.465 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 99.922 -1.984 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.649 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.649 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.968 -2.666 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.569 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 103.942 -1.962 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.569 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C3'-C2'-C1' 99.104 -2.569 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 99.805 -2.068 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 98.721 -2.842 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.494 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.438 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.494 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.23 0 C3'-C2'-C1' 99.839 -2.043 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.621 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.689 -2.151 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.621 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 99.113 -2.562 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.564 -2.24 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.445 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.694 0 O4'-C1'-C2' 103.692 -2.189 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.478 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 C3'-C2'-C1' 99.802 -2.07 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.085 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 99.618 -2.201 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.521 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.288 -2.437 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.521 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.537 -2.259 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.497 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 99.933 -1.977 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 C3'-C2'-C1' 99.182 -2.513 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.49 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.139 0 C3'-C2'-C1' 99.341 -2.399 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . 0.401 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-P-OP1 106.661 -0.496 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.401 ' C8 ' H2'' ' D' ' -1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 101.77 -0.664 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 C4'-C3'-C2' 102.396 -0.804 . . . . 1.97 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.602 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C1'-O4'-C4' 107.591 -1.507 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.602 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.959 0 C4'-C3'-C2' 104.467 1.267 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.408 " H1'" " H5'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 C5'-C4'-C3' 116.29 1.06 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.408 " H5'" " H1'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 N19-C1'-C2' 115.946 1.091 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.569 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 104.319 1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 105.388 1.92 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-C2' 107.109 0.917 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.677 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 98.098 -3.287 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.677 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C4'-C3'-C2' 103.866 0.666 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.597 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.529 1.134 0 C3'-C2'-C1' 104.775 1.482 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.469 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O4'--C1' 1.407 -0.965 0 C1'-O4'-C4' 107.495 -1.575 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.554 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.679 0 C3'-C2'-C1' 105.41 1.936 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 105.822 2.23 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.515 " O5'" " H1'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.621 1.192 0 P-O3'-C3' 120.659 0.799 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.468 ' C2 ' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C3'-C2'-C1' 101.316 -0.989 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.732 0 C4'-C3'-C2' 103.988 0.788 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.559 " C2'" ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.559 ' H71' " C2'" ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 101.62 -0.772 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.403 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.362 -1.67 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.961 0 C4'-C3'-C2' 104.547 1.347 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.373 0.13 . . . . 5.8 111.004 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.78 83.01 0.23 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 123.513 0.725 . . . . 5.35 111.272 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -63.39 140.35 76.01 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.245 1.964 . . . . 2.43 111.631 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.03 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 0.76 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.665 HD22 ' OG ' ' A' ' 21' ' ' SER . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 0.99 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 1.51 110.368 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.67 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 0.71 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 0.68 112.015 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.4 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 1.47 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 0.77 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.37 111.558 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 0.77 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.33 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 1.32 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 1.44 112.286 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 0.77 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.38 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.665 ' OG ' HD22 ' A' ' 6' ' ' LEU . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.08 113.376 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.524 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 2.55 111.727 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 38' ' ' VAL . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 1.63 110.55 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 49' ' ' PRO . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.38 110.805 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.61 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.7 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.1 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 1.98 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.38 108.264 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.11 111.865 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.32 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.13 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 1.75 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 0.99 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.34 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.45 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 23' ' ' VAL . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 1.45 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.87 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 0.88 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 0.71 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 1.47 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 0.93 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 0.99 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.2 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.553 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.23 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 1.88 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.47 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 0.84 111.804 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.465 HD22 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.1 110.169 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 4.72 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.584 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 0.66 110.694 178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.487 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.46 112.742 -178.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.45 110.25 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.737 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 0.78 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.08 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.66 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 4.79 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.541 ' NE2' H5'' ' C' ' 11' ' ' ' DG' . 0.5 OUTLIER 51.12 99.53 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.34 113.339 179.085 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -88.66 23.96 2.13 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.165 -0.334 . . . . 3.86 111.497 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.181 -0.914 . . . . 6.96 111.137 -179.827 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 44.9 mtp . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.782 0.325 . . . . 6.92 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -88.46 127.51 56.49 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.436 -0.347 . . . . 6.42 110.233 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.415 ' O ' HG22 ' B' ' 4' ' ' VAL . 87.4 Cg_endo -83.39 -10.47 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.902 2.401 . . . . 2.1 112.325 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.631 HG22 ' HA ' ' B' ' 47' ' ' TYR . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 1.43 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.726 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 0.81 110.005 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.57 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 0.61 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 1.32 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.94 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.14 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 0.72 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.89 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 1.46 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 0.67 112.337 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 0.72 109.991 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.1 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.444 ' O ' HG12 ' B' ' 20' ' ' VAL . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.49 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.666 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.43 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 0.78 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.444 HG12 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.08 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.12 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 1.88 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' B' ' 35' ' ' ARG . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.39 109.538 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.31 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.19 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.3 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.08 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.25 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 1.75 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.466 HG11 HG22 ' B' ' 23' ' ' VAL . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.35 109.831 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' SER . . . . . 0.514 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.58 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.27 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.2 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.05 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.54 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.5 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 1.38 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.07 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 0.91 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 0.73 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.4 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.03 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 0.84 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.56 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.631 ' HA ' HG22 ' B' ' 4' ' ' VAL . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.88 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 1.6 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' PRO . . . . . 0.461 ' O ' H5'' ' C' ' 12' ' ' ' DA' . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.09 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.39 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.83 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ALA . . . . . 0.425 ' HB3' " H5'" ' C' ' 12' ' ' ' DA' . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 0.63 109.916 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.658 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.33 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.03 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.669 HD13 HD22 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.21 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 0.99 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 93.09 38.73 5.34 Favored Glycine 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.09 113.787 177.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.476 ' HA ' ' HE2' ' B' ' 59' ' ' LYS . 9.2 mmpt? -87.79 -29.12 21.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.953 0.406 . . . . 5.92 110.327 178.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -119.99 101.27 7.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.859 -0.423 . . . . 4.83 109.859 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' SER . . . . . 0.427 ' C ' ' HG ' ' B' ' 62' ' ' LEU . 9.6 m -99.76 -10.08 22.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 6.09 111.68 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.427 ' HG ' ' C ' ' B' ' 61' ' ' SER . 2.1 mt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.099 -0.953 . . . . 7.79 109.878 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.082 -2.584 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.425 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.365 0 O4'-C1'-C2' 103.988 -1.92 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.481 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.703 0 C3'-C2'-C1' 99.666 -2.167 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.825 H2'' ' H71' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.709 0 O4'-C1'-C2' 103.751 -2.135 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.825 ' H71' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 C3'-C2'-C1' 98.596 -2.931 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.747 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.722 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.48 ' H73' ' C8 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.713 0 C3'-C2'-C1' 99.334 -2.404 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.423 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.891 -2.006 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.423 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.116 0 C3'-C2'-C1' 99.317 -2.416 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.5 -1.479 0 C3'-C2'-C1' 99.487 -2.295 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 103.953 -1.952 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.726 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 P--O3' 1.621 1.125 0 C3'-C2'-C1' 99.496 -2.288 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.493 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.777 -2.088 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.536 H5'' ' HG3' ' B' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 103.745 -2.141 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.407 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 98.74 -2.828 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.598 -0.784 0 C3'-C2'-C1' 99.247 -2.466 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 C3'-C2'-C1' 99.198 -2.501 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.637 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.701 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.709 " H1'" ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 99.162 -2.527 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.709 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.553 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.775 -2.089 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 99.573 -2.234 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.764 -2.097 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 100.884 -1.297 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.654 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 N19-C1'-C2' 116.527 1.454 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.654 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 101.684 -0.726 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.546 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 105.232 1.809 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.661 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.871 -2.021 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.661 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.265 0 O4'-C1'-N19 108.47 0.837 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.666 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 P--O3' 1.618 0.878 0 C5'-C4'-C3' 116.747 1.364 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 107.666 -1.453 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.995 0 C1'-O4'-C4' 107.853 -1.319 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.742 H2'' " O5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.805 0 C1'-O4'-C4' 107.144 -1.826 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.742 " O5'" H2'' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.007 -1.209 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.272 0.67 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.737 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C4'-C3'-C2' 104.557 1.357 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.487 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C1'-O4'-C4' 106.273 -2.448 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.673 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C3'-C2'-C1' 105.195 1.782 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.683 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.616 0.742 0 O4'-C4'-C3' 104.337 -1.263 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C4'-C3'-C2' 102.204 -0.996 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.524 H2'' ' N7 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.929 0 O4'-C1'-C2' 104.62 -1.345 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.524 ' N7 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 C3'-C2'-C1' 103.97 0.907 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 N19-C1'-C2' 116.66 1.538 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C1'-O4'-C4' 107.368 -1.665 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.401 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 N19-C1'-C2' 116.778 1.611 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.401 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.412 -0.632 0 O4'-C4'-C3' 106.472 0.872 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 ttp . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.746 0.307 . . . . 5.8 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -86.54 120.14 71.82 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.644 -0.502 . . . . 5.35 109.644 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.26 114.32 1.97 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.17 1.913 . . . . 2.43 111.18 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.03 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.419 ' O ' HG23 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 0.76 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 0.99 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 1.51 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.67 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 0.71 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 0.68 111.149 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.4 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.47 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 0.77 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.37 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 0.77 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.33 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.498 ' O ' HD12 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 1.32 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.465 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.1 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 1.44 110.478 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 0.77 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.38 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.456 ' HA ' HG23 ' A' ' 24' ' ' VAL . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.08 111.364 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 2.55 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 1.63 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.486 HG13 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.38 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.61 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.551 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.7 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.1 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 1.98 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.493 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.38 112.343 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.11 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.32 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.13 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 1.75 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 0.99 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.34 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.45 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 1.45 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.87 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 0.88 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 0.71 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 1.47 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 0.93 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 0.99 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.2 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.23 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 1.88 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 0.84 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.1 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 4.72 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 0.66 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.46 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.45 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.699 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 0.78 111.827 178.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.08 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.66 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 4.79 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -56.26 -31.44 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.34 111.304 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 70.24 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 3.86 111.136 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-N 115.814 -0.63 . . . . 6.96 109.796 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.003 0.43 . . . . 6.92 110.986 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -102.64 140.52 21.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 C-N-CA 120.829 -0.348 . . . . 6.42 110.522 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.51 -169.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.56 2.173 . . . . 2.1 111.938 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 1.43 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.517 ' O ' HG23 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 0.81 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 0.61 110.155 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 1.32 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.94 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.14 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ALA . . . . . 0.453 ' HA ' HG21 ' B' ' 20' ' ' VAL . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 0.72 112.077 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.89 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 1.46 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 0.67 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 0.72 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.559 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.1 112.6 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.49 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.63 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 1.4 tp60 -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.43 111.509 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.422 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 0.78 111.856 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.453 HG21 ' HA ' ' B' ' 10' ' ' ALA . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.08 111.255 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.12 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.576 ' HG2' ' HB3' ' B' ' 27' ' ' ALA . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 1.88 111.156 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 19' ' ' THR . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.39 108.309 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.31 110.436 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.19 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.3 113.139 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.576 ' HB3' ' HG2' ' B' ' 22' ' ' ARG . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.08 112.187 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.25 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 1.75 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 27' ' ' ALA . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.35 109.696 175.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.58 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.422 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.27 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.2 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG13 ' B' ' 38' ' ' VAL . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.05 112.661 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.422 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.54 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.5 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.408 HG13 ' O ' ' B' ' 34' ' ' THR . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 1.38 110.685 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.07 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 0.91 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 0.73 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.4 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.03 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 0.84 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.56 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.88 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 1.6 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.705 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.09 109.162 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.48 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.39 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.83 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 0.63 111.569 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.33 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.03 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.21 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 0.99 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.45 31.22 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.09 111.381 174.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.47 ' HE2' " H4'" ' C' ' 13' ' ' ' DG' . 24.6 mtmt -141.6 43.87 1.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.741 -0.229 . . . . 5.92 110.654 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.466 ' OE1' ' HG3' ' B' ' 55' ' ' GLN . 20.1 mm-40 -42.71 94.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.876 0.695 . . . . 4.83 112.876 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 4.6 p -106.36 -14.21 15.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.091 -0.504 . . . . 6.09 109.824 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.4 mt . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.979 -1.009 . . . . 7.79 111.506 179.862 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.263 0 C3'-C2'-C1' 99.297 -2.431 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.572 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.234 0 C3'-C2'-C1' 99.709 -2.136 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.572 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 O4'-C1'-C2' 103.939 -1.965 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.493 ' OP2' ' HA ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.626 -2.195 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.401 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.917 0 C3'-C2'-C1' 99.108 -2.566 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.483 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.714 0 C3'-C2'-C1' 99.751 -2.106 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.515 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.09 0 C3'-C2'-C1' 98.714 -2.847 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.52 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.071 0 C3'-C2'-C1' 99.571 -2.235 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.52 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.023 0 C3'-C2'-C1' 99.107 -2.566 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.334 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 104.047 -1.866 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.669 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.908 0 C3'-C2'-C1' 99.891 -2.007 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.815 -2.775 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.47 " H4'" ' HE2' ' B' ' 59' ' ' LYS . . . . . . . . 0 C2'--C1' 1.509 -0.844 0 C3'-C2'-C1' 99.739 -2.115 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.802 0 C3'-C2'-C1' 99.493 -2.29 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 99.674 -2.161 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.627 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 99.673 -2.162 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.627 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.683 0 C3'-C2'-C1' 99.234 -2.476 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.562 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 99.651 -2.178 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.597 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.83 -2.05 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.425 -2.339 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.002 0 C3'-C2'-C1' 99.682 -2.155 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.854 0 C4'-C3'-C2' 104.247 1.047 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.599 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.022 -1.913 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.599 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.613 0.515 0 C4'-C3'-C2' 102.325 -0.875 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.452 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.456 1.968 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.452 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 100.81 -1.35 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.403 H2'' ' OP2' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 104.47 1.264 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.63 ' H73' ' HB3' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 104.139 1.028 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.502 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C1'-O4'-C4' 106.978 -1.944 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C4'-C3'-C2' 104.397 1.197 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 101.165 -1.097 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.536 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.443 0.937 0 C4'-C3'-C2' 104.586 1.386 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.622 1.273 0 P-O3'-C3' 120.89 0.992 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.699 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.176 0 C4'-C3'-C2' 104.563 1.363 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.423 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.232 -1.763 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.573 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C3'-C2'-C1' 105.298 1.856 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.573 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.734 0 C3'-C2'-C1' 106.577 2.769 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.777 " H1'" " O4'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.277 0 C3'-C2'-C1' 105.567 2.048 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.777 " O4'" " H1'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.906 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 102.201 -0.999 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.414 ' C5 ' ' H73' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.198 -1.073 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.414 ' H73' ' C5 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C1'-O4'-C4' 106.962 -1.956 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.505 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C3'-C2'-C1' 101.062 -1.17 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.505 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 N19-C1'-C2' 115.248 0.655 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 tpp . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.577 0.227 . . . . 5.8 110.969 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -80.88 125.16 80.73 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.84 -0.43 . . . . 5.35 109.84 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.45 86.6 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.758 1.639 . . . . 2.43 111.667 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 4' ' ' VAL . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.03 108.983 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 0.76 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 0.99 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 1.51 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.67 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 0.71 110.504 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 0.68 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.4 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 1.47 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 0.77 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.37 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.489 HG11 ' CG2' ' A' ' 34' ' ' THR . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 0.77 110.02 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.33 110.895 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.587 ' HB2' HD12 ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 1.32 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 8.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 1.44 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 0.77 110.381 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.693 ' O ' HG22 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.38 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 2.55 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 1.63 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.38 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.61 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.7 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.1 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 1.98 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.38 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.11 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.32 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.13 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 1.75 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.489 ' CG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 0.99 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.34 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.45 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 1.45 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.87 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 0.88 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 0.71 111.851 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 1.47 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 0.93 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 0.99 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.2 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.23 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 1.88 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.631 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 0.84 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.1 109.464 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.64 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 4.72 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 0.66 112.566 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 11.5 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.46 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.45 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.829 HD22 HD13 ' B' ' 56' ' ' LEU . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 0.78 111.129 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.08 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.66 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 4.79 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -63.83 103.45 0.57 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.34 111.234 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -75.92 124.82 27.97 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.76 -0.655 . . . . 3.86 110.262 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.808 -0.615 . . . . 6.96 110.17 179.359 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.285 -0.265 . . . . 6.92 110.285 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.483 ' HZ2' " H3'" ' C' ' 11' ' ' ' DG' . 15.2 tppt? -168.61 98.45 0.54 Allowed Pre-proline 0 CA--C 1.534 0.329 0 O-C-N 123.721 0.638 . . . . 6.42 110.026 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.529 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo -82.82 -73.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.055 1.837 . . . . 2.1 111.538 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 1.43 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.409 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 0.81 110.572 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 0.61 109.035 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 1.32 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.94 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.422 ' H ' HG23 ' B' ' 9' ' ' VAL . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.14 110.652 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.72 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.89 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 1.46 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 0.67 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 0.72 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.1 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.49 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.43 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 0.78 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.08 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.629 ' O ' HG12 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.12 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.456 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 1.88 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.39 110.755 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.629 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.31 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.19 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.3 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ALA . . . . . 0.513 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.08 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.444 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.25 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' HIS . . . . . 0.537 ' HB3' ' H72' ' D' ' 4' ' ' ' DT' . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 1.75 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 27' ' ' ALA . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.35 110.968 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.58 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.27 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.2 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.05 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.54 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.5 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 1.38 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.07 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 0.91 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 0.73 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.4 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.03 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 0.84 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.56 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.88 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.529 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 1.6 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.515 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.09 108.029 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.39 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.83 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 0.63 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.423 ' HG2' " C5'" ' C' ' 13' ' ' ' DG' . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.33 111.949 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.03 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.829 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.21 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 0.99 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.26 28.81 4.72 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.09 113.997 -177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' B' ' 59' ' ' LYS . 5.0 mtpt -97.61 47.59 1.02 Allowed 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 118.086 0.943 . . . . 5.92 109.481 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.422 HE21 " H4'" ' D' ' 10' ' ' ' DT' . 93.6 mt-30 -112.49 86.32 2.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.572 -0.74 . . . . 4.83 109.447 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -32.1 42.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.977 -0.556 . . . . 6.09 110.176 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 mt . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.441 -0.799 . . . . 7.79 110.421 179.76 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.414 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.087 0 C3'-C2'-C1' 99.09 -2.579 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.573 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.217 0 C3'-C2'-C1' 99.365 -2.382 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.573 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.446 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.51 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.43 -2.335 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.51 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C3'-C2'-C1' 99.342 -2.399 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.466 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.076 0 C3'-C2'-C1' 99.613 -2.205 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.466 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.3 -2.429 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.472 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.472 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.066 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -1.418 0 C3'-C2'-C1' 99.676 -2.16 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C1'-C2' 103.983 -1.924 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.601 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.42 -1.258 0 C3'-C2'-C1' 99.889 -2.008 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.013 0 C3'-C2'-C1' 99.144 -2.54 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.471 " C2'" ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.842 0 C3'-C2'-C1' 99.638 -2.187 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.471 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 99.047 -2.609 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.941 0 C3'-C2'-C1' 100.073 -1.876 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . 0.461 H2'' ' C6 ' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.627 -2.195 . . . . 1.63 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.461 ' C6 ' H2'' ' C' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 99.772 -2.091 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.38 -2.371 . . . . 1.1 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.026 -2.624 . . . . 1.2 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.43 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.153 0 C3'-C2'-C1' 99.803 -2.069 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.43 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.413 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 C3'-C2'-C1' 99.306 -2.424 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . 0.5 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 108.686 1.108 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.568 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 100.838 -1.33 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.568 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C4'-C3'-C2' 102.502 -0.698 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.492 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C4'-C3'-C2' 104.675 1.475 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.537 ' H72' ' HB3' ' B' ' 29' ' ' HIS . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 O4'-C1'-C2' 105.0 -1.0 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.609 " C2'" ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 104.263 1.117 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.609 ' H72' " C2'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.531 0.687 0 O4'-C1'-C2' 107.24 1.036 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.594 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.949 0 C1'-O4'-C4' 107.044 -1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.79 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.859 0 C1'-O4'-C4' 106.989 -1.937 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.79 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.863 -0.598 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.59 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 100.273 -1.733 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.59 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C4'-C3'-C2' 104.304 1.104 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.682 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.424 -0.982 0 C3'-C2'-C1' 104.905 1.575 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.549 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.555 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 C3'-C2'-C1' 101.093 -1.148 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.555 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.657 0 O4'-C1'-C2' 105.131 -0.881 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.497 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C2'-C3'-O3' 113.03 0.9 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.497 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 N19-C1'-C2' 115.982 1.114 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.453 ' N7 ' ' C2 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.913 0 O4'-C1'-N19 108.668 1.085 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.463 ' C2 ' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C1'-C2' 104.936 -1.058 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.463 ' C6 ' ' C2 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 C4'-C3'-C2' 104.154 0.954 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.539 H2'' ' C5 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C3'-C2'-C1' 101.055 -1.175 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.539 ' C5 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 C3'-C2'-C1' 101.714 -0.704 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.655 0.264 . . . . 5.8 110.469 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.55 116.86 63.0 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.846 -0.428 . . . . 5.35 109.846 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.81 114.92 2.36 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.731 1.621 . . . . 2.43 111.248 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.03 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 0.76 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 0.99 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 1.51 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.67 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 0.71 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 0.68 111.71 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.4 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 1.47 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 0.77 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.37 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 0.77 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.33 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HB2' HD12 ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 1.32 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 5.6 tp-100 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 1.44 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG11 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 0.77 112.142 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.38 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.08 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' NH2' ' N7 ' ' C' ' 5' ' ' ' DG' . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 2.55 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 1.63 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.38 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.61 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.7 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.1 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 1.98 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.38 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 HH11 ' A' ' 22' ' ' ARG . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.11 111.029 -178.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.32 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.13 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 1.75 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 0.99 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.34 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.45 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.442 HG23 HG11 ' A' ' 23' ' ' VAL . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 1.45 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.87 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 0.88 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 0.71 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.445 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 1.47 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 0.93 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.478 ' O ' HG21 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 0.99 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.2 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.23 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 1.88 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 0.84 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.573 HD22 " C5'" ' D' ' 12' ' ' ' DG' . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.1 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 4.72 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 0.66 111.132 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.46 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 92.3 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.45 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.658 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 0.78 111.762 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.08 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.66 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 4.79 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.461 ' HB3' ' HB3' ' B' ' 2' ' ' LYS . 23.4 mp0 -56.83 -34.03 67.34 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.34 111.548 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' B' ' 2' ' ' LYS . 73.9 m -85.14 34.49 0.56 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.805 -0.634 . . . . 3.86 110.923 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 62' ' ' LEU . 11.3 tp . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.232 -0.89 . . . . 6.96 109.536 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.776 0.322 . . . . 6.92 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' GLN . 2.1 pttm -153.51 70.8 6.76 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.293 -0.412 . . . . 6.42 110.751 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -92.18 -151.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.832 2.355 . . . . 2.1 112.732 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.407 ' H ' HG12 ' B' ' 4' ' ' VAL . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 1.43 108.609 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.513 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 0.81 111.593 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 0.61 108.366 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 1.32 109.501 177.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.94 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.14 109.956 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 0.72 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.89 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 1.46 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 0.67 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.459 HG11 HG23 ' B' ' 34' ' ' THR . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 0.72 109.648 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.1 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.49 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.43 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.427 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 0.78 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.568 ' O ' HG12 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.08 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.12 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.446 ' CZ ' ' H72' ' D' ' 4' ' ' ' DT' . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 1.88 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.568 HG12 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.39 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.31 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.19 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.3 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.08 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.25 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 1.75 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.35 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.58 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.27 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.2 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.459 HG23 HG11 ' B' ' 15' ' ' VAL . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.05 110.367 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.54 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.5 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 1.38 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.07 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.91 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 0.73 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.4 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.03 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 0.84 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.56 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.88 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 1.6 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.705 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.09 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.39 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.83 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 0.63 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.705 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.33 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 5.1 pt20 -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.03 111.676 -178.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.624 HD13 HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.21 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 0.99 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 119.48 15.92 5.28 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.09 113.469 178.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 22.9 mttp -104.91 86.68 2.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.295 -1.002 . . . . 5.92 108.295 179.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -153.7 128.91 9.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.262 -0.881 . . . . 4.83 110.922 -176.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.47 -18.53 44.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 6.09 111.575 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 68.6 mt . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.629 -0.714 . . . . 7.79 111.536 179.423 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.03 0 C3'-C2'-C1' 99.33 -2.407 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.609 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 C3'-C2'-C1' 99.399 -2.358 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.609 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-C2' 103.685 -2.196 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.498 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.366 -2.382 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.498 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.929 0 C3'-C2'-C1' 98.908 -2.708 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.495 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 O4'-C1'-C2' 104.027 -1.884 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.495 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.869 -2.022 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 C3'-C2'-C1' 99.262 -2.456 . . . . 1.07 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 100.12 -1.843 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.578 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.942 -1.97 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.513 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.291 0 C3'-C2'-C1' 98.266 -3.167 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.491 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 99.781 -2.085 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.491 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.039 0 C3'-C2'-C1' 98.774 -2.804 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.412 ' OP2' " H2'" ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.801 0 C3'-C2'-C1' 99.505 -2.282 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 C3'-C2'-C1' 100.042 -1.899 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.52 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.947 0 C3'-C2'-C1' 99.661 -2.171 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.52 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.931 0 C3'-C2'-C1' 98.959 -2.672 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.635 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.945 0 C3'-C2'-C1' 99.294 -2.433 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.635 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.82 0 C3'-C2'-C1' 99.353 -2.39 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.43 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 98.866 -2.738 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.43 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.277 -2.445 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.923 -1.269 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.624 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 100.272 -1.734 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.624 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.676 0.697 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.513 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.657 0 C3'-C2'-C1' 105.403 1.931 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.513 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 P--O3' 1.623 1.306 0 C4'-C3'-C2' 104.416 1.216 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O4'-C1'-C2' 106.665 0.514 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 N19-C1'-C2' 115.818 1.011 . . . . 1.26 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.924 0 C3'-C2'-C1' 104.848 1.534 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 105.238 1.813 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.555 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 108.294 0.618 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.504 H2'' " O5'" ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 N19-C1'-C2' 116.1 1.188 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.528 -0.837 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.658 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.116 0 C1'-O4'-C4' 107.737 -1.402 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.426 ' C4 ' ' C5 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.851 0 C1'-O4'-C4' 107.221 -1.771 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.503 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C4'-C3'-C2' 104.624 1.424 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.503 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.441 0.75 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.593 " H1'" ' C6 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.22 0 C3'-C2'-C1' 104.999 1.642 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.593 ' C6 ' " H1'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.624 1.382 0 C5'-C4'-C3' 116.806 1.404 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C5'-C4'-O4' 108.116 -0.803 . . . . 1.56 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 N19-C1'-C2' 116.239 1.275 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 103.966 0.766 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.437 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 N19-C1'-C2' 115.25 0.656 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.437 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 101.473 -0.876 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.6 mmt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.207 -0.294 . . . . 5.8 110.207 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -97.25 112.46 61.0 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.39 -0.368 . . . . 5.35 110.674 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -67.25 102.37 0.68 Allowed 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 122.334 2.023 . . . . 2.43 111.934 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 0.76 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.6 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 0.99 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 1.51 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.67 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.441 ' H ' HG23 ' A' ' 9' ' ' VAL . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.71 109.13 177.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 0.68 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.4 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 1.47 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 0.77 111.945 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.37 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 13' ' ' ALA . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 0.77 110.047 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.4 ' CB ' " H2'" ' C' ' 5' ' ' ' DG' . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.33 110.499 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB2' HD22 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 1.32 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 1.44 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 0.77 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.38 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.434 ' HA ' HG22 ' A' ' 24' ' ' VAL . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.08 110.593 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.453 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 2.55 110.328 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 1.63 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 21' ' ' SER . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.38 111.044 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.61 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.7 112.647 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.1 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 1.98 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.38 110.044 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.11 109.813 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.515 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.32 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.13 112.162 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 1.75 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 0.99 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.34 110.757 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.45 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 1.45 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.87 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.88 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 0.71 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 1.47 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 0.93 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.99 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.2 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.23 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 1.88 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 0.84 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.1 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.477 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 4.72 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.461 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 0.66 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.46 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.45 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.48 HD21 ' N3 ' ' C' ' 11' ' ' ' DG' . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 0.78 109.487 -179.38 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.08 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.66 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 4.79 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 -73.46 -67.17 0.61 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.34 108.701 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.4 m -146.86 16.66 1.24 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.255 -1.016 . . . . 3.86 108.255 178.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 49.0 tp . . . . . 0 C--O 1.239 0.511 0 CA-C-N 115.389 -0.823 . . . . 6.96 111.048 179.809 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.598 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 65.0 mtt . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 109.769 -0.456 . . . . 6.92 109.769 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -103.62 94.87 6.56 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.743 -0.466 . . . . 6.42 109.743 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.598 ' HD3' ' O ' ' B' ' 1' ' ' MET . 56.5 Cg_endo -100.2 132.72 0.18 Allowed 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 123.276 2.651 . . . . 2.1 113.032 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 1.43 109.209 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 0.81 111.399 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 0.61 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 1.32 108.546 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.94 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.14 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 0.72 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.89 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.426 ' HB2' HD11 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 1.46 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 0.67 111.433 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 0.72 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.1 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.49 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.43 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.407 ' HA ' ' HB2' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 0.78 111.072 -179.346 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.08 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.12 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' B' ' 19' ' ' THR . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 1.88 111.802 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.701 HG11 HG21 ' B' ' 38' ' ' VAL . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.39 109.32 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.31 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.19 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.3 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.08 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.25 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 1.75 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.35 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.58 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.27 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.2 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.05 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.54 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.5 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.701 HG21 HG11 ' B' ' 23' ' ' VAL . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 1.38 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.07 110.202 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 0.91 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 0.73 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.4 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.03 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 0.84 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.56 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.451 ' HA ' HG22 ' B' ' 4' ' ' VAL . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.88 110.65 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 1.6 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.559 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.09 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.39 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.559 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.83 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 0.63 110.711 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.33 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.03 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.21 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 0.99 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 131.56 25.97 0.75 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.09 114.379 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -125.54 96.25 4.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 117.906 0.853 . . . . 5.92 109.92 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 -72.29 107.6 4.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.167 -0.924 . . . . 4.83 110.807 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.95 -51.54 4.21 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.517 -0.765 . . . . 6.09 112.077 -178.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' B' ' 62' ' ' LEU . 1.4 mm? . . . . . 0 C--O 1.252 1.23 0 O-C-N 124.105 0.878 . . . . 7.79 109.634 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.449 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.746 0 C3'-C2'-C1' 99.5 -2.286 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.552 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.451 0 O4'-C1'-C2' 103.695 -2.186 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.552 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.716 0 O4'-C1'-C2' 103.544 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.754 H2'' ' H71' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C1'-C2' 103.763 -2.125 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' H71' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.419 -1.283 0 C3'-C2'-C1' 98.968 -2.665 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 100.127 -1.838 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.517 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 C3'-C2'-C1' 99.607 -2.209 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.517 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.312 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.514 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.105 0 O4'-C1'-C2' 103.905 -1.995 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.514 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.424 0 C3'-C2'-C1' 98.798 -2.787 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.507 ' C4 ' ' C4 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.064 0 C3'-C2'-C1' 99.363 -2.384 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.515 ' N2 ' ' HB3' ' B' ' 56' ' ' LEU . . . . . . . . 0 P--O3' 1.616 0.729 0 C3'-C2'-C1' 99.454 -2.319 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.454 ' C6 ' ' C6 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.275 0 C3'-C2'-C1' 98.505 -2.996 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.4 " C2'" ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.452 0.57 0 C3'-C2'-C1' 99.877 -2.016 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.4 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.325 -2.411 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.872 -2.026 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.218 -2.487 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.986 0 C3'-C2'-C1' 99.858 -2.03 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.516 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 98.747 -2.823 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.479 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C3'-C2'-C1' 99.509 -2.279 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.445 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.822 0 O4'-C1'-C2' 103.661 -2.217 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.443 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.37 -2.378 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.353 0 C3'-C2'-C1' 99.198 -2.501 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 N19-C1'-C2' 116.036 1.147 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.823 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 C3'-C2'-C1' 99.608 -2.209 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.823 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.657 1.398 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.537 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.79 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.537 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C4'-C3' 106.435 0.835 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.765 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-C2' 107.078 0.89 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.765 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.534 0.938 0 C3'-C2'-C1' 104.842 1.53 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.692 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.529 1.053 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 C1'-O4'-C4' 107.499 -1.572 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.516 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.897 0 C4'-C3'-C2' 104.471 1.271 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.516 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.444 1.027 0 C3'-C2'-C1' 105.922 2.301 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.622 1.252 0 P-O3'-C3' 120.966 1.055 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.479 " H1'" " O4'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -1.018 0 C3'-C2'-C1' 105.026 1.662 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.6 ' OP2' ' HG ' ' A' ' 6' ' ' LEU . . . . . . . . 0 P--O3' 1.596 -0.913 0 C1'-O4'-C4' 106.707 -2.138 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.593 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.592 1.392 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.57 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 104.685 1.418 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.501 ' C8 ' " C2'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 101.181 -1.085 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.525 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.68 -2.157 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.525 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 C5'-C4'-O4' 108.253 -0.717 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.402 ' OP2' H2'' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-C2' 104.623 -1.342 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.216 1.016 . . . . 1.69 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 P-O5'-C5' 119.825 -0.672 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.827 0 N19-C1'-C2' 115.437 0.773 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.612 0.244 . . . . 5.8 111.108 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' HB3' HG23 ' A' ' 4' ' ' VAL . 23.6 mmtt -140.07 135.69 16.54 Favored Pre-proline 0 C--O 1.235 0.304 0 N-CA-C 109.721 -0.474 . . . . 5.35 109.721 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -84.63 47.51 2.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.829 2.353 . . . . 2.43 112.073 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 2' ' ' LYS . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.03 108.632 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.477 ' O ' HG23 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 0.76 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.455 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 0.99 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 1.51 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.67 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 0.71 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.68 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.4 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 1.47 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 0.77 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.37 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 0.77 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.33 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.455 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 1.32 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 1.44 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 0.77 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.604 ' O ' HG22 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.38 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.08 113.321 -178.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.48 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 2.55 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 1.63 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.38 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.61 113.037 -178.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.7 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.1 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 1.98 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.38 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.48 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.11 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.32 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.13 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 1.75 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 0.99 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.34 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.45 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.432 ' HB ' HG12 ' A' ' 20' ' ' VAL . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 1.45 112.175 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.87 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 0.88 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 0.71 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.618 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 1.47 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 0.93 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 0.99 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.2 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.23 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 1.88 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 0.84 111.905 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.1 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 4.72 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.579 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 0.66 112.257 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.568 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.46 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.45 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.753 HD22 HD13 ' B' ' 56' ' ' LEU . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 0.78 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.08 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.66 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 4.79 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER 49.83 37.56 13.71 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.34 112.893 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 m -87.99 75.44 8.76 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.379 0.511 . . . . 3.86 112.379 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 6.96 109.652 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.424 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 89.2 mmm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.872 0.368 . . . . 6.92 110.239 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -97.77 103.94 19.18 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.101 -0.499 . . . . 6.42 109.912 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' B' ' 1' ' ' MET . 73.7 Cg_endo -94.49 90.69 0.12 Allowed 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.188 1.925 . . . . 2.1 112.154 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 1.43 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.432 ' HA ' ' OP2' ' C' ' 12' ' ' ' DA' . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 0.81 111.699 -177.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 6' ' ' LEU . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 0.61 108.695 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 1.32 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.94 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.14 110.632 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 0.72 111.625 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.89 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 1.46 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 0.67 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 0.72 110.331 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.1 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.49 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.559 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.43 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.78 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.08 111.179 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.12 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 1.88 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.517 HG11 ' HB ' ' B' ' 38' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.39 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.31 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.19 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.3 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.08 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.25 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 1.75 109.744 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.466 ' CG1' HG22 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.35 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.58 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ALA . . . . . 0.681 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.27 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.501 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.2 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.05 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.681 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.54 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.501 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.5 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.517 ' HB ' HG11 ' B' ' 23' ' ' VAL . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 1.38 112.14 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.07 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 0.91 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 0.73 110.476 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.4 110.554 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.03 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 0.84 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.56 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.88 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 1.6 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.512 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.09 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.39 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.42 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.83 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 0.63 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.33 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.03 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.21 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 0.99 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 63.33 0.26 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.09 112.715 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -84.13 68.05 9.95 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.415 -0.462 . . . . 5.92 111.004 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -94.05 121.67 35.77 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.193 -0.603 . . . . 4.83 109.984 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.38 -30.09 60.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.071 -0.513 . . . . 6.09 110.82 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.483 -0.77 . . . . 7.79 110.098 -179.681 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.555 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.885 0 C3'-C2'-C1' 99.573 -2.233 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.555 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.5 -1.503 0 C3'-C2'-C1' 99.593 -2.219 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C1'-C2' 103.757 -2.13 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.444 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.248 0 C3'-C2'-C1' 99.389 -2.365 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.444 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.153 -2.534 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.524 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 O4'-C1'-C2' 103.686 -2.194 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.524 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.871 0 C3'-C2'-C1' 99.644 -2.183 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.423 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.883 -2.012 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.445 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 C3'-C2'-C1' 99.558 -2.244 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.445 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-C2' 103.874 -2.024 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.484 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.059 0 C3'-C2'-C1' 100.194 -1.79 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.512 " H4'" HD22 ' B' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.424 -0.981 0 C3'-C2'-C1' 99.376 -2.374 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.432 ' OP2' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.506 -1.068 0 C3'-C2'-C1' 99.228 -2.48 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.897 0 C3'-C2'-C1' 100.066 -1.881 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.479 -2.301 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.559 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.507 -0.967 0 C3'-C2'-C1' 99.148 -2.537 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.264 0 C3'-C2'-C1' 99.699 -2.144 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 99.692 -2.148 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.563 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.847 0 C3'-C2'-C1' 99.73 -2.122 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.563 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 99.304 -2.425 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.822 0 C3'-C2'-C1' 99.682 -2.155 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.772 0 C3'-C2'-C1' 99.544 -2.254 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C3'-C2'-C1' 99.027 -2.623 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C1'-O4'-C4' 110.517 0.584 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 N19-C1'-C2' 115.822 1.014 . . . . 2.52 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.79 H2'' ' H71' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.173 -1.09 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.79 ' H71' H2'' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 C3'-C2'-C1' 105.294 1.853 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.547 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 N19-C1'-C2' 114.889 0.43 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.512 -0.559 0 O4'-C4'-C3' 104.35 -1.25 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.786 -1.367 . . . . 1.26 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.753 0 C4'-C3'-C2' 104.623 1.423 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 105.407 1.933 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.439 -2.33 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.422 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 N19-C1'-C2' 116.335 1.335 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.422 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.497 0.57 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.735 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.531 1.328 0 C1'-O4'-C4' 106.486 -2.296 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.587 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 107.086 -1.867 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.566 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 C3'-C2'-C1' 100.961 -1.242 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.444 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.497 0 C3'-C2'-C1' 100.622 -1.485 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-N19 108.427 0.784 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.65 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.436 -2.331 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.65 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.94 0 N19-C1'-C2' 113.219 -0.613 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 C3'-C2'-C1' 100.837 -1.331 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.413 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C5'-C4'-O4' 107.95 -0.906 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.413 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 100.59 -1.507 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.759 0 O4'-C1'-C2' 105.052 -0.953 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.481 1.122 0 CA-C-O 121.107 0.479 . . . . 5.8 110.049 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -101.22 142.26 24.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.971 -0.559 . . . . 5.35 109.902 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.19 68.55 7.86 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.96 1.773 . . . . 2.43 112.05 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.03 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 0.76 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 0.99 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 1.51 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.474 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.67 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 0.71 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 0.68 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.4 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 1.47 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 0.77 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.37 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 0.77 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.33 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 1.32 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.532 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.6 tp-100 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 1.44 110.687 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 0.77 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.38 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.08 111.974 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.473 ' CZ ' ' H73' ' C' ' 4' ' ' ' DT' . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 2.55 111.023 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 1.63 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.38 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.61 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.7 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.1 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 1.98 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.38 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.11 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.32 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.13 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 1.75 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 0.99 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.596 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.34 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.45 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 1.45 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.87 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 0.88 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.71 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 1.47 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 0.93 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 0.99 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.2 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.23 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 1.88 109.994 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.585 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 0.84 112.606 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.1 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 4.72 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 0.66 109.762 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.46 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 62' ' ' LEU . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.45 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.721 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 0.78 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.08 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.66 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 4.79 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER 73.69 17.08 3.73 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.34 110.977 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.59 -43.61 3.63 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 108.909 -0.774 . . . . 3.86 108.909 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.572 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.359 -1.305 . . . . 6.96 109.038 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.904 0.383 . . . . 6.92 111.046 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.604 ' O ' HG13 ' B' ' 4' ' ' VAL . 40.1 tttm -136.14 115.62 11.05 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.247 -0.433 . . . . 6.42 109.9 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.18 90.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.843 2.362 . . . . 2.1 111.688 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' VAL . . . . . 0.604 HG13 ' O ' ' B' ' 2' ' ' LYS . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 1.43 111.442 -178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.6 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 0.81 110.236 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 0.61 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 1.32 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.94 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.419 HG23 ' H ' ' B' ' 9' ' ' VAL . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.14 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 0.72 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.89 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' TYR . . . . . 0.424 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 1.46 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 0.67 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 0.72 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.1 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' TYR . . . . . 0.432 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.49 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.582 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.43 111.828 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 0.78 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.08 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.481 ' HB2' ' H72' ' C' ' 14' ' ' ' DT' . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.12 110.619 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 1.88 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.69 HG11 HG21 ' B' ' 38' ' ' VAL . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.39 110.183 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.31 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.19 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.3 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.08 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.25 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 1.75 115.364 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.443 HG13 ' CB ' ' B' ' 22' ' ' ARG . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.35 111.315 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.58 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.27 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.2 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.05 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.54 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.5 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.69 HG21 HG11 ' B' ' 23' ' ' VAL . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 1.38 111.231 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.07 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 0.91 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.73 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.4 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.03 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 0.84 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' B' ' 2' ' ' LYS . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.56 112.02 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' TYR . . . . . 0.41 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.88 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 1.6 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.522 ' HB3' " C5'" ' C' ' 12' ' ' ' DA' . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.09 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.39 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.83 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 0.63 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.33 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.568 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.03 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.712 HD13 HD22 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.21 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 0.99 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 177.17 49.06 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.09 112.445 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.479 ' HG2' ' OE1' ' B' ' 60' ' ' GLN . 12.5 pttm -45.0 -22.55 0.09 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.505 0.928 . . . . 5.92 113.505 177.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.479 ' OE1' ' HG2' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -76.01 4.99 7.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.241 0.544 . . . . 4.83 111.316 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m -91.97 120.85 33.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.194 0.521 . . . . 6.09 109.661 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 C--O 1.247 0.962 0 CA-C-N 114.747 -1.115 . . . . 7.79 111.41 179.973 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.961 0 C3'-C2'-C1' 99.307 -2.423 . . . . 2.41 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.412 " H1'" ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.324 0 C3'-C2'-C1' 99.596 -2.217 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.412 ' C8 ' " H1'" ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.673 0 O4'-C1'-C2' 103.752 -2.135 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.645 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.458 1.099 0 C3'-C2'-C1' 99.731 -2.12 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.645 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 99.227 -2.481 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.69 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.448 -2.323 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.69 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-C2' 103.613 -2.261 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.425 ' H8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.899 0 C3'-C2'-C1' 99.572 -2.234 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.483 -2.298 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.359 0 O4'-C1'-C2' 103.889 -2.01 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.4 ' O2 ' ' HG ' ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C4' 1.456 0.885 0 O4'-C1'-C2' 103.729 -2.156 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.584 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 99.527 -2.266 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.6 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.152 0 C3'-C2'-C1' 99.24 -2.472 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.598 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 C3'-C2'-C1' 99.651 -2.178 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.598 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 99.405 -2.354 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.055 0 C3'-C2'-C1' 99.372 -2.377 . . . . 1.36 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 99.471 -2.306 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . 0.57 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.847 0 C3'-C2'-C1' 99.478 -2.301 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.57 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.453 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.087 0 C3'-C2'-C1' 99.075 -2.589 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.457 0.997 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . 0.472 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.416 -2.346 . . . . 1.81 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . 0.472 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.362 -2.384 . . . . 2.28 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 N19-C1'-C2' 116.043 1.152 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.571 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C3'-C2'-C1' 100.212 -1.777 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.571 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 110.644 0.674 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.553 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.696 0 C3'-C2'-C1' 105.251 1.822 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.553 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-C2' 105.025 -0.977 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . 0.44 H2'' ' OP2' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.048 0 C3'-C2'-C1' 104.136 1.026 . . . . 1.13 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.582 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 N19-C1'-C2' 116.297 1.31 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . 0.557 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 105.355 1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C4'-C3'-C2' 104.608 1.408 . . . . 1.68 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.469 ' C5 ' ' H73' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 100.567 -1.523 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.541 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.139 -2.544 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.541 ' C5 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 C3'-C2'-C1' 101.701 -0.714 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.721 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.53 1.211 0 C1'-O4'-C4' 105.863 -2.741 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.709 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.527 0.93 0 C3'-C2'-C1' 105.22 1.8 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.464 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.749 0 O4'-C1'-C2' 104.617 -1.348 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 O4'-C4'-C3' 106.523 0.923 . . . . 1.14 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.564 0 C3'-C2'-C1' 100.531 -1.55 . . . . 1.59 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.433 H2'' ' H8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.753 0 O4'-C1'-C2' 104.816 -1.167 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.433 ' H8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.833 0 C1'-O4'-C4' 110.298 0.427 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C4'-C3'-C2' 104.035 0.835 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.524 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C4'-C3'-C2' 104.329 1.129 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.537 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 100.549 -1.536 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.571 1.371 . . . . 2.49 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tmm? . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.974 -0.38 . . . . 5.8 109.974 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' O ' HG23 ' A' ' 4' ' ' VAL . 32.8 ttpt -117.02 136.78 23.39 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.753 -0.462 . . . . 5.35 109.753 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 28.0 Cg_exo -65.97 75.39 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.017 2.478 . . . . 2.43 112.765 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.03 108.898 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 0.76 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 0.99 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 1.51 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.482 ' HB2' HG12 ' A' ' 4' ' ' VAL . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.67 109.98 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.461 ' HB ' HG21 ' A' ' 20' ' ' VAL . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 0.71 110.774 179.134 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.68 110.913 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.4 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.56 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 1.47 110.165 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.58 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 0.77 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.37 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 0.77 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.33 109.753 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.428 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 1.32 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 4.7 tp-100 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 1.44 110.182 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 0.77 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG21 ' HB ' ' A' ' 9' ' ' VAL . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.38 110.564 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.08 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 2.55 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 1.63 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.38 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.61 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.7 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.1 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 1.98 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.38 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.11 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.32 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.13 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 1.75 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 0.99 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.34 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.58 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.45 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 1.45 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.87 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 0.88 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.56 ' HB1' ' HD2' ' A' ' 12' ' ' TYR . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 0.71 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 1.47 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 0.93 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 0.99 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.2 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.23 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 1.88 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 0.84 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.1 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 4.72 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.53 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.66 109.619 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.46 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.682 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.45 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.713 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 0.78 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.08 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.411 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.66 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.682 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 4.79 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.537 HE22 " C5'" ' C' ' 11' ' ' ' DG' . 5.0 mt-30 -79.07 126.91 31.33 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.34 110.448 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 98.1 11.57 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.023 -0.535 . . . . 3.86 109.886 179.254 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.259 -0.877 . . . . 6.96 110.743 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 ttt . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.026 -0.361 . . . . 6.92 110.026 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' LYS . . . . . 0.45 ' H ' ' HD2' ' B' ' 2' ' ' LYS . 0.0 OUTLIER -106.02 132.93 20.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.888 0.375 . . . . 6.42 110.177 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -83.9 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.497 2.131 . . . . 2.1 113.099 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 1.43 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' THR . . . . . 0.461 ' HA ' ' P ' ' C' ' 12' ' ' ' DA' . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 0.81 110.394 -177.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.52 ' HA ' HD23 ' B' ' 6' ' ' LEU . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 0.61 108.956 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 1.32 109.689 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.94 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' VAL . . . . . 0.44 ' H ' HG23 ' B' ' 9' ' ' VAL . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.14 111.698 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 0.72 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.89 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 1.46 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 0.67 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 0.72 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' SER . . . . . 0.465 ' O ' HG23 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.1 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.49 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.502 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.43 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 0.78 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.08 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.12 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 1.88 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' VAL . . . . . 0.443 HG22 HG11 ' B' ' 30' ' ' VAL . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.39 109.961 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.31 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.19 110.993 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.3 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.08 113.117 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.25 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 1.75 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.443 HG11 HG22 ' B' ' 23' ' ' VAL . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.35 109.849 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.58 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.27 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.2 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.05 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.54 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.5 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 1.38 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.07 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 0.91 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 0.73 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.4 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.03 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 45' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' B' ' 46' ' ' ASN . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 0.84 112.021 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 45' ' ' LEU . 32.4 t30 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.56 110.76 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.88 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.4 HD11 HD21 ' B' ' 46' ' ' ASN . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 1.6 107.421 178.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ASN . . . . . 0.473 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.09 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.39 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' CYS . . . . . 0.473 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.83 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 0.63 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.33 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.415 ' HA ' ' HB2' ' B' ' 59' ' ' LYS . 3.7 pt20 -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.03 110.695 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.657 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.21 109.753 179.463 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 0.99 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 107.1 107.81 3.23 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.09 111.167 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' B' ' 54' ' ' GLN . 7.5 mtpp -131.85 9.0 4.52 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.077 0.465 . . . . 5.92 110.049 179.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -118.61 118.79 32.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.779 -0.646 . . . . 4.83 109.516 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.4 m -82.26 2.02 33.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.536 -0.302 . . . . 6.09 111.337 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' B' ' 62' ' ' LEU . 3.0 mm? . . . . . 0 C--O 1.245 0.835 0 O-C-N 123.784 0.678 . . . . 7.79 110.44 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' -1' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 99.387 -2.367 . . . . 2.41 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 1' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 C3'-C2'-C1' 99.176 -2.517 . . . . 2.12 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 2' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.723 0 C3'-C2'-C1' 99.851 -2.035 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 3' ' ' ' DA' . . . . . 0.57 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.069 0 C3'-C2'-C1' 99.095 -2.575 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 4' ' ' ' DT' . . . . . 0.57 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.601 0 C3'-C2'-C1' 98.683 -2.869 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 5' ' ' ' DG' . . . . . 0.506 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.864 0 C3'-C2'-C1' 99.634 -2.19 . . . . 0.83 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 6' ' ' ' DT' . . . . . 0.506 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.848 0 C3'-C2'-C1' 99.457 -2.316 . . . . 0.92 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 7' ' ' ' DG' . . . . . 0.412 ' N7 ' ' OH ' ' A' ' 17' ' ' TYR . . . . . . . . 0 C2'--C1' 1.504 -1.189 0 C3'-C2'-C1' 99.212 -2.491 . . . . 1.07 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 8' ' ' ' DA' . . . . . 0.613 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.731 0 C3'-C2'-C1' 99.511 -2.278 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 9' ' ' ' DG' . . . . . 0.613 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.355 0 C3'-C2'-C1' 99.718 -2.13 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 10' ' ' ' DC' . . . . . 0.429 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.1 0 C3'-C2'-C1' 99.736 -2.117 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 11' ' ' ' DG' . . . . . 0.647 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.508 -0.957 0 C3'-C2'-C1' 99.752 -2.105 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 12' ' ' ' DA' . . . . . 0.508 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 98.868 -2.737 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.997 -1.931 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.482 " H1'" ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.083 0 C3'-C2'-C1' 98.794 -2.79 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ' DA' . . . . . 0.482 ' C8 ' " H1'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 O4'-C1'-C2' 103.945 -1.959 . . . . 1.36 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 99.559 -2.243 . . . . 1.63 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . 0.52 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.31 -2.422 . . . . 1.1 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 19' ' ' ' DA' . . . . . 0.524 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 C3'-C2'-C1' 99.626 -2.196 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.524 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.07 0 C3'-C2'-C1' 99.977 -1.945 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.527 -2.266 . . . . 1.81 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 99.368 -2.38 . . . . 2.28 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 C4'-C3'-C2' 104.162 0.962 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 1' ' ' ' DG' . . . . . 0.599 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 100.945 -1.253 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 2' ' ' ' DG' . . . . . 0.599 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C4'-C3'-C2' 101.861 -1.339 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 3' ' ' ' DT' . . . . . 0.428 H2'' ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.971 -1.235 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 4' ' ' ' DT' . . . . . 0.428 ' C5 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C4'-C3'-C2' 104.239 1.039 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C1'-O4'-C4' 110.489 0.563 . . . . 1.13 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 6' ' ' ' DT' . . . . . 0.501 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C4'-C3'-C2' 102.4 -0.8 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.745 1.545 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 8' ' ' ' DA' . . . . . 0.661 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 105.233 1.809 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 9' ' ' ' DC' . . . . . 0.661 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C5'-C4'-C3' 113.586 -0.743 . . . . 1.68 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 10' ' ' ' DT' . . . . . 0.553 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.728 -2.123 . . . . 1.41 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 11' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C1'-O4'-C4' 110.553 0.609 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 12' ' ' ' DG' . . . . . 0.713 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C4'-C3'-C2' 104.423 1.223 . . . . 1.19 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 13' ' ' ' DC' . . . . . 0.414 " H2'" ' C6 ' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.741 0 C1'-O4'-C4' 106.626 -2.196 . . . . 0.64 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 14' ' ' ' DT' . . . . . 0.414 ' C6 ' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 104.846 -1.14 . . . . 0.77 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C5'-C4'-C3' 115.667 0.645 . . . . 1.14 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' D' D ' 16' ' ' ' DA' . . . . . 0.56 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-C2' 105.079 -0.928 . . . . 1.59 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 17' ' ' ' DC' . . . . . 0.575 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.342 -0.689 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 18' ' ' ' DA' . . . . . 0.575 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-C2' 107.454 1.231 . . . . 1.56 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 19' ' ' ' DT' . . . . . 0.518 " O4'" " H1'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.614 1.414 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 20' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.768 -0.666 . . . . 1.69 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 21' ' ' ' DT' . . . . . 0.484 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 N19-C1'-C2' 116.231 1.269 . . . . 2.14 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.421 -0.781 0 C4'-C3'-C2' 104.382 1.182 . . . . 2.49 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo . . . . . 0 N--CA 1.455 -0.794 0 N-CA-C 110.2 -0.731 . . . . 2.4300000000000002 110.2 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.03 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 0.76000000000000001 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.459 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 0.98999999999999999 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 1.51 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.6699999999999999 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 0.70999999999999996 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.445 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 0.68000000000000005 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.3999999999999999 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 1.47 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 0.77000000000000002 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.3700000000000001 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 0.77000000000000002 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.3300000000000001 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 1.3200000000000001 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 1.4399999999999999 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 0.77000000000000002 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.71 HG12 HG13 ' A' ' 38' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.3799999999999999 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.0800000000000001 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 2.5499999999999998 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 1.6299999999999999 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.3799999999999999 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.6100000000000001 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.7000000000000002 110.148 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.415 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.1000000000000001 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.98 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.3799999999999999 110.023 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.1100000000000001 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.3200000000000001 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.1299999999999999 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 1.75 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 0.98999999999999999 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.3399999999999999 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.45 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.71 HG13 HG12 ' A' ' 20' ' ' VAL . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 1.45 112.084 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.8700000000000001 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 0.88 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 0.70999999999999996 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 1.47 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 0.93000000000000005 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 0.98999999999999999 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.2000000000000002 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.23 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 1.8799999999999999 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 0.83999999999999997 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.581 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.1000000000000001 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 4.7199999999999998 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.524 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77000000000000002 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 0.66000000000000003 111.112 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.46 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.602 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.45 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.639 HD22 HD13 ' B' ' 56' ' ' LEU . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 0.78000000000000003 111.575 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.0800000000000001 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.6599999999999999 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 4.79 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.602 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 6.2 mp0 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.3399999999999999 110.239 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo . . . . . 0 CA--C 1.529 0.271 0 CA-C-O 120.903 0.293 . . . . 2.1000000000000001 112.116 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 1.4299999999999999 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 8' ' ' ASP . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 0.81000000000000005 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 0.60999999999999999 109.175 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 1.3200000000000001 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.9399999999999999 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' B' ' 41' ' ' ALA . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.1399999999999999 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.71999999999999997 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.8899999999999999 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.412 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 1.46 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 0.67000000000000004 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 0.71999999999999997 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.1000000000000001 110.594 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.49 111.03 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.4299999999999999 111.343 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 0.78000000000000003 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.0800000000000001 111.466 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.1200000000000001 109.982 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.558 ' HB3' HG22 ' B' ' 30' ' ' VAL . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 1.8799999999999999 110.573 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.459 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.3899999999999999 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.3100000000000001 110.22 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.1899999999999999 110.758 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.2999999999999998 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.0800000000000001 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.25 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 1.75 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.558 HG22 ' HB3' ' B' ' 22' ' ' ARG . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.3500000000000001 111.857 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.5800000000000001 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.694 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.27 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.2000000000000002 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.05 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.694 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.54 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.5 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' B' ' 23' ' ' VAL . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 1.3799999999999999 113.948 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.0699999999999998 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 0.91000000000000003 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.554 ' HB3' HG13 ' B' ' 9' ' ' VAL . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 0.72999999999999998 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.3999999999999999 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.03 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1000000000000001 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 0.83999999999999997 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.5600000000000001 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.471 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.88 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 1.6000000000000001 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.0900000000000001 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.3900000000000001 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.82999999999999996 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 0.63 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.3300000000000001 111.143 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.449 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.0299999999999998 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 56' ' ' LEU . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.21 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 0.98999999999999999 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.0899999999999999 113.382 179.702 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.458 -0.574 0 N-CA-C 113.772 0.643 . . . . 2.4300000000000002 113.772 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.03 109.766 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 0.76000000000000001 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.603 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 0.98999999999999999 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 1.51 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.6699999999999999 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 0.70999999999999996 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 0.68000000000000005 111.164 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.3999999999999999 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 1.47 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 0.77000000000000002 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.3700000000000001 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 0.77000000000000002 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.424 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.3300000000000001 109.876 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.603 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 1.3200000000000001 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 1.4399999999999999 111.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 0.77000000000000002 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.416 HG12 ' HB ' ' A' ' 38' ' ' VAL . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.3799999999999999 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.0800000000000001 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 2.5499999999999998 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 35' ' ' ARG . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 1.6299999999999999 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.3799999999999999 109.329 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.6100000000000001 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.7000000000000002 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.486 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.1000000000000001 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 1.98 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.3799999999999999 111.029 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.1100000000000001 112.795 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.3200000000000001 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.1299999999999999 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 1.75 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 0.98999999999999999 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.618 ' HA ' HG21 ' A' ' 23' ' ' VAL . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.3399999999999999 109.601 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.45 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 20' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 1.45 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.8700000000000001 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 0.88 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.70999999999999996 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 1.47 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 0.93000000000000005 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 0.98999999999999999 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.2000000000000002 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.23 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 1.8799999999999999 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 0.83999999999999997 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.1000000000000001 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 4.7199999999999998 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77000000000000002 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 0.66000000000000003 113.039 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.46 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.45 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.92 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 0.78000000000000003 112.412 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.0800000000000001 113.241 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.6599999999999999 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 4.79 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.3399999999999999 109.885 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.464 -0.257 0 CA-C-O 121.247 0.436 . . . . 2.1000000000000001 112.236 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.429 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 1.4299999999999999 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 0.81000000000000005 111.585 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 0.60999999999999999 107.116 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 1.3200000000000001 110.579 178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.9399999999999999 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.651 HG21 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.1399999999999999 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 0.71999999999999997 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.8899999999999999 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 1.46 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 0.67000000000000004 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.725 HG21 HG22 ' B' ' 38' ' ' VAL . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 0.71999999999999997 109.304 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.1000000000000001 109.746 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.49 111.804 -178.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.4299999999999999 110.649 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 0.78000000000000003 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.0800000000000001 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.453 ' O ' HG12 ' B' ' 24' ' ' VAL . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.1200000000000001 110.251 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.424 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 1.8799999999999999 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.63 HG22 HG11 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.3899999999999999 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.453 HG12 ' O ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.3100000000000001 112.635 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.1899999999999999 110.821 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.2999999999999998 109.453 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.0800000000000001 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.614 ' H ' HG23 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.25 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 46.6 m80 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 1.75 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.63 HG11 HG22 ' B' ' 23' ' ' VAL . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.3500000000000001 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.451 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.5800000000000001 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.27 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.2000000000000002 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.05 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.54 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.5 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.725 HG22 HG21 ' B' ' 15' ' ' VAL . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 1.3799999999999999 113.24 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.0699999999999998 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 0.91000000000000003 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' B' ' 9' ' ' VAL . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 0.72999999999999998 111.315 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.3999999999999999 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.03 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1000000000000001 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 0.83999999999999997 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.5600000000000001 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.651 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.88 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 1.6000000000000001 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.0900000000000001 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.3900000000000001 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.503 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.82999999999999996 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 0.63 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.3300000000000001 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.0299999999999998 111.483 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.92 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.21 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 0.98999999999999999 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.0899999999999999 112.236 174.692 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.446 -1.266 0 N-CA-C 110.461 -0.631 . . . . 2.4300000000000002 110.461 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 0.76000000000000001 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 0.98999999999999999 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 1.51 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.6699999999999999 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 0.70999999999999996 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 0.68000000000000005 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.3999999999999999 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 1.47 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 0.77000000000000002 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.3700000000000001 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 0.77000000000000002 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.3300000000000001 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 1.3200000000000001 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 1.4399999999999999 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 0.77000000000000002 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.3799999999999999 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.0800000000000001 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 2.5499999999999998 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 1.6299999999999999 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.3799999999999999 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.6100000000000001 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.7000000000000002 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.1000000000000001 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 1.98 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.3799999999999999 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.1100000000000001 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.3200000000000001 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.1299999999999999 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 1.75 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 0.98999999999999999 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.3399999999999999 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.45 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 1.45 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.8700000000000001 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 0.88 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.70999999999999996 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 1.47 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 0.93000000000000005 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.98999999999999999 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.2000000000000002 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.23 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 1.8799999999999999 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 0.83999999999999997 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.1000000000000001 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 4.7199999999999998 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77000000000000002 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.618 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 0.66000000000000003 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.46 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.45 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.484 HD22 HD13 ' B' ' 56' ' ' LEU . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 0.78000000000000003 111.117 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.0800000000000001 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.6599999999999999 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 4.79 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 . . . . . 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.3399999999999999 111.012 -179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo . . . . . 0 N--CA 1.445 -1.337 0 CA-C-O 121.186 0.411 . . . . 2.1000000000000001 111.696 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 1.4299999999999999 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.507 ' O ' HG23 ' B' ' 9' ' ' VAL . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 0.81000000000000005 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 6' ' ' LEU . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 0.60999999999999999 107.827 178.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 1.3200000000000001 109.438 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.9399999999999999 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.599 ' HA ' HD12 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.1399999999999999 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 0.71999999999999997 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.8899999999999999 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 1.46 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.514 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 0.67000000000000004 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 0.71999999999999997 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.1000000000000001 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.49 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.4299999999999999 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 0.78000000000000003 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.0800000000000001 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.1200000000000001 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 1.8799999999999999 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.511 HG22 HG11 ' B' ' 30' ' ' VAL . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.3899999999999999 109.873 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.3100000000000001 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.1899999999999999 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.2999999999999998 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.415 ' HB2' HD21 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.0800000000000001 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.25 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 1.75 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.511 HG11 HG22 ' B' ' 23' ' ' VAL . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.3500000000000001 108.967 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.5800000000000001 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.27 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.2000000000000002 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.05 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.54 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.5 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 1.3799999999999999 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.0699999999999998 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 0.91000000000000003 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 0.72999999999999998 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.3999999999999999 111.109 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.03 111.588 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1000000000000001 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 0.83999999999999997 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.5600000000000001 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.636 ' HA ' HG22 ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.88 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 1.6000000000000001 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.0900000000000001 109.849 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.3900000000000001 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.82999999999999996 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 0.63 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.3300000000000001 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.0299999999999998 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.618 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.21 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 0.98999999999999999 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.0899999999999999 112.964 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo . . . . . 0 N--CA 1.455 -0.778 0 N-CA-C 109.699 -0.923 . . . . 2.4300000000000002 109.699 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.03 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 0.76000000000000001 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 0.98999999999999999 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 1.51 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.6699999999999999 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 0.70999999999999996 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 0.68000000000000005 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.3999999999999999 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 1.47 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 0.77000000000000002 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.3700000000000001 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.412 HG21 ' HB ' ' A' ' 19' ' ' THR . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 0.77000000000000002 116.011 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.3300000000000001 110.864 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.45 ' HB2' HD12 ' A' ' 6' ' ' LEU . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 1.3200000000000001 114.733 178.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 1.4399999999999999 111.457 178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG21 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 0.77000000000000002 111.542 -178.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' HG22 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.3799999999999999 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.495 ' HB2' HD22 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.0800000000000001 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 2.5499999999999998 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.723 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 1.6299999999999999 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.3799999999999999 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.6100000000000001 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.7000000000000002 109.864 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.1000000000000001 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 1.98 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.9 m80 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.3799999999999999 110.789 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.1100000000000001 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.3200000000000001 112.597 -178.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.1299999999999999 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 1.75 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 0.98999999999999999 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.3399999999999999 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.45 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 1.45 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.8700000000000001 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 0.88 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 0.70999999999999996 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 0.93000000000000005 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 0.98999999999999999 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.2000000000000002 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.23 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 1.8799999999999999 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 0.83999999999999997 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.1000000000000001 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.543 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 4.7199999999999998 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77000000000000002 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 0.66000000000000003 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.53 ' OE1' ' HA ' ' A' ' 51' ' ' ARG . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.46 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 16.4 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.45 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 0.78000000000000003 112.888 -179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.0800000000000001 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.6599999999999999 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 4.79 110.125 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.3399999999999999 112.185 179.467 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo . . . . . 0 N--CA 1.456 -0.718 0 CA-C-O 121.0 0.334 . . . . 2.1000000000000001 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 1.4299999999999999 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 0.81000000000000005 110.8 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 0.60999999999999999 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 1.3200000000000001 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.9399999999999999 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.1399999999999999 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 0.71999999999999997 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.8899999999999999 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.442 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 1.46 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.458 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 0.67000000000000004 113.236 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 0.71999999999999997 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.1000000000000001 110.521 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.49 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.4299999999999999 111.121 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 0.78000000000000003 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.406 HG13 HD22 ' B' ' 6' ' ' LEU . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.0800000000000001 109.639 179.085 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.1200000000000001 108.29 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 1.8799999999999999 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.3899999999999999 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.3100000000000001 109.3 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.1899999999999999 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.2999999999999998 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.0800000000000001 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.25 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 1.75 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.412 HG11 ' HA ' ' B' ' 23' ' ' VAL . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.3500000000000001 112.421 -179.605 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.5800000000000001 109.771 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.27 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.2000000000000002 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.05 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.54 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.458 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.5 112.699 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 1.3799999999999999 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.0699999999999998 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 0.91000000000000003 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.3999999999999999 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.03 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1000000000000001 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 0.83999999999999997 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.5600000000000001 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.524 ' HA ' HG22 ' B' ' 4' ' ' VAL . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.88 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 1.6000000000000001 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.437 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.0900000000000001 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.3900000000000001 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.437 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.82999999999999996 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 0.63 111.046 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.3300000000000001 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.0299999999999998 112.171 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.21 110.061 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 0.98999999999999999 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.0899999999999999 113.711 178.323 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo . . . . . 0 C--O 1.234 0.295 0 CA-C-O 121.403 0.501 . . . . 2.4300000000000002 112.189 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.588 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.03 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.76000000000000001 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.53 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 0.98999999999999999 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 1.51 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.556 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.6699999999999999 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 0.70999999999999996 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 0.68000000000000005 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.3999999999999999 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 1.47 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 0.77000000000000002 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.3700000000000001 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 0.77000000000000002 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.3300000000000001 110.332 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 1.3200000000000001 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 1.4399999999999999 110.461 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 0.77000000000000002 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.3799999999999999 109.488 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.517 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.0800000000000001 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 2.5499999999999998 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 20' ' ' VAL . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 1.6299999999999999 111.365 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.3799999999999999 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.6100000000000001 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.7000000000000002 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.1000000000000001 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 1.98 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.3799999999999999 110.58 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.1100000000000001 110.135 -178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.3200000000000001 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.1299999999999999 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 1.75 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.599 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 0.98999999999999999 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.3399999999999999 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.45 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 1.45 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.8700000000000001 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 0.88 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 0.70999999999999996 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.704 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 1.47 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 0.93000000000000005 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 0.98999999999999999 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.2000000000000002 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.588 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.23 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 1.8799999999999999 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HB3' HG11 ' A' ' 24' ' ' VAL . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 0.83999999999999997 113.278 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.1000000000000001 109.512 178.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.581 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 4.7199999999999998 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77000000000000002 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.636 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 0.66000000000000003 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.46 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.45 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.65 HD22 HD13 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 0.78000000000000003 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.0800000000000001 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.6599999999999999 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 4.79 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.3399999999999999 111.267 -178.684 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.827 0.678 . . . . 2.1000000000000001 113.491 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 1.4299999999999999 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 0.81000000000000005 111.099 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.499 HD22 ' CG1' ' B' ' 20' ' ' VAL . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 0.60999999999999999 108.483 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 1.3200000000000001 109.227 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.9399999999999999 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.1399999999999999 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 0.71999999999999997 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.8899999999999999 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 1.46 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 0.71999999999999997 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.1000000000000001 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.49 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.542 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 5.4 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.4299999999999999 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 0.78000000000000003 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.499 ' CG1' HD22 ' B' ' 6' ' ' LEU . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.0800000000000001 109.979 178.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.1200000000000001 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 1.8799999999999999 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.3899999999999999 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.3100000000000001 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.1899999999999999 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.2999999999999998 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.0800000000000001 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.25 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 1.75 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.3500000000000001 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.5800000000000001 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.27 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.2000000000000002 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.05 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.614 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.54 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.5 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 1.3799999999999999 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.0699999999999998 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.606 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 0.91000000000000003 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.72999999999999998 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.3999999999999999 111.717 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.03 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . 0.606 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1000000000000001 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 0.83999999999999997 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.5600000000000001 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.49 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.88 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 1.6000000000000001 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.0900000000000001 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.3900000000000001 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.82999999999999996 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 0.63 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.3300000000000001 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.0299999999999998 111.212 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.65 HD13 HD22 ' A' ' 56' ' ' LEU . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.21 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 0.98999999999999999 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.0899999999999999 113.786 178.89 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo . . . . . 0 CA--C 1.528 0.179 0 CA-C-O 121.004 0.335 . . . . 2.4300000000000002 112.857 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.473 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.03 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 0.76000000000000001 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.567 HD23 ' H ' ' A' ' 6' ' ' LEU . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 0.98999999999999999 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 1.51 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.463 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.6699999999999999 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 0.70999999999999996 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 0.68000000000000005 111.212 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.3999999999999999 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 1.47 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 0.77000000000000002 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.3700000000000001 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 0.77000000000000002 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.3300000000000001 108.913 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.408 ' O ' HD12 ' A' ' 6' ' ' LEU . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 1.3200000000000001 111.059 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 1.4399999999999999 110.511 -179.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 0.77000000000000002 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.3799999999999999 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.0800000000000001 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 2.5499999999999998 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 1.6299999999999999 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.3799999999999999 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.6100000000000001 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.7000000000000002 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.1000000000000001 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 1.98 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.3799999999999999 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.1100000000000001 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.534 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.3200000000000001 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.477 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.1299999999999999 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 1.75 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.534 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 0.98999999999999999 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.3399999999999999 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.45 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 1.45 112.339 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.8700000000000001 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 0.88 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 0.70999999999999996 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 1.47 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 0.93000000000000005 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.98999999999999999 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.2000000000000002 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.23 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 1.8799999999999999 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 0.83999999999999997 113.667 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.1000000000000001 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 4.7199999999999998 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77000000000000002 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.406 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 0.66000000000000003 109.833 179.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.46 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.577 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.45 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.727 HD22 HD13 ' B' ' 56' ' ' LEU . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 0.78000000000000003 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.0800000000000001 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.6599999999999999 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 4.79 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.518 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.3399999999999999 114.076 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo . . . . . 0 CA--C 1.536 0.623 0 CA-C-O 121.112 0.38 . . . . 2.1000000000000001 112.581 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' B' ' 47' ' ' TYR . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 1.4299999999999999 110.974 178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.403 ' O ' HG23 ' B' ' 9' ' ' VAL . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 0.81000000000000005 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 0.60999999999999999 109.439 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 1.3200000000000001 110.555 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.9399999999999999 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 5' ' ' THR . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.1399999999999999 110.931 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 0.71999999999999997 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.8899999999999999 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.426 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 1.46 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 0.67000000000000004 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 0.71999999999999997 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.1000000000000001 112.046 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.49 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.4299999999999999 111.629 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 0.78000000000000003 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.0800000000000001 110.823 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.1200000000000001 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.686 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 1.8799999999999999 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB2' ' B' ' 35' ' ' ARG . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.3899999999999999 110.557 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.3100000000000001 111.222 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.1899999999999999 110.877 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.2999999999999998 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.686 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.0800000000000001 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.529 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.25 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 32.1 m80 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 1.75 111.846 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.436 HG11 HG22 ' B' ' 23' ' ' VAL . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.3500000000000001 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.5800000000000001 110.671 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.691 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.27 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.2000000000000002 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.05 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.54 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.5 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 1.3799999999999999 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.0699999999999998 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 0.91000000000000003 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.3999999999999999 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.03 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1000000000000001 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.426 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 0.83999999999999997 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . 0.532 ' OD1' HD11 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.5600000000000001 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 4' ' ' VAL . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.88 109.378 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.532 HD11 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 1.6000000000000001 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.0900000000000001 109.137 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.3900000000000001 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.82999999999999996 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 0.63 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.3300000000000001 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' B' ' 56' ' ' LEU . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.0299999999999998 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 56' ' ' LEU . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.21 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 0.98999999999999999 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.0899999999999999 112.451 172.885 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo . . . . . 0 C--O 1.236 0.379 0 CA-C-O 121.614 0.589 . . . . 2.4300000000000002 112.859 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.03 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 0.76000000000000001 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 20' ' ' VAL . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 0.98999999999999999 111.591 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 1.51 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.6699999999999999 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 0.70999999999999996 110.225 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 0.68000000000000005 111.752 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.3999999999999999 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 1.47 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 0.77000000000000002 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.3700000000000001 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 0.77000000000000002 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.3300000000000001 109.393 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.402 ' O ' HD13 ' A' ' 6' ' ' LEU . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 1.3200000000000001 111.075 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 1.4399999999999999 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 0.77000000000000002 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.496 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.3799999999999999 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.0800000000000001 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 2.5499999999999998 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 1.6299999999999999 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.3799999999999999 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.6100000000000001 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.7000000000000002 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.1000000000000001 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 1.98 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.3799999999999999 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.1100000000000001 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.3200000000000001 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.1299999999999999 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 1.75 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.604 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 0.98999999999999999 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.3399999999999999 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.45 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 1.45 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.8700000000000001 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 0.88 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 0.70999999999999996 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 1.47 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 0.93000000000000005 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 0.98999999999999999 111.45 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.2000000000000002 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.23 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.439 HD13 ' HA ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 1.8799999999999999 108.608 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 0.83999999999999997 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.1000000000000001 109.379 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 4.7199999999999998 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77000000000000002 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.565 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 0.66000000000000003 110.002 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.549 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.46 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.45 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.582 HD22 HD13 ' B' ' 56' ' ' LEU . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 0.78000000000000003 112.135 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.0800000000000001 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.6599999999999999 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 4.79 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.3399999999999999 111.853 178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.56 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo . . . . . 0 N--CA 1.456 -0.7 0 CA-C-O 120.305 0.044 . . . . 2.1000000000000001 112.142 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' B' ' 47' ' ' TYR . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 1.4299999999999999 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 0.81000000000000005 110.091 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.612 HD22 HG11 ' B' ' 20' ' ' VAL . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 0.60999999999999999 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 1.3200000000000001 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.9399999999999999 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.1399999999999999 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.71999999999999997 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.8899999999999999 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 1.46 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 0.67000000000000004 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 0.71999999999999997 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.1000000000000001 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.49 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.516 HE21 ' HG3' ' B' ' 22' ' ' ARG . 10.1 tp60 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.4299999999999999 112.228 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.506 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 0.78000000000000003 110.893 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.612 HG11 HD22 ' B' ' 6' ' ' LEU . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.0800000000000001 110.016 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.1200000000000001 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' HE21 ' B' ' 18' ' ' GLN . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 1.8799999999999999 110.495 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' B' ' 35' ' ' ARG . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.3899999999999999 109.849 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.3100000000000001 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.1899999999999999 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.2999999999999998 110.972 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.0800000000000001 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.25 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 1.75 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 23' ' ' VAL . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.3500000000000001 111.351 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.421 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.5800000000000001 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.27 109.442 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.2000000000000002 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.05 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.576 ' HA ' HG21 ' B' ' 23' ' ' VAL . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.54 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.5 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 1.3799999999999999 112.599 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.0699999999999998 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 0.91000000000000003 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.72999999999999998 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.3999999999999999 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.03 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1000000000000001 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 0.83999999999999997 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.5600000000000001 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.546 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.88 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 1.6000000000000001 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . 0.497 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.429 ' H ' HG22 ' B' ' 48' ' ' ILE . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.0900000000000001 110.044 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.3900000000000001 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.82999999999999996 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 0.63 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.3300000000000001 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.61 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.0299999999999998 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.582 HD13 HD22 ' A' ' 56' ' ' LEU . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.21 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 0.98999999999999999 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.0899999999999999 113.668 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo . . . . . 0 C--O 1.233 0.248 0 N-CA-C 113.271 0.45 . . . . 2.4300000000000002 113.271 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.03 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 0.76000000000000001 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.548 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 0.98999999999999999 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 1.51 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.6699999999999999 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 0.70999999999999996 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.58 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 0.68000000000000005 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.3999999999999999 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 1.47 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 0.77000000000000002 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.3700000000000001 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 0.77000000000000002 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.58 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.3300000000000001 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.548 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 1.3200000000000001 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 1.4399999999999999 110.501 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 0.77000000000000002 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.421 HG12 HG13 ' A' ' 38' ' ' VAL . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.3799999999999999 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.0800000000000001 111.995 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 2.5499999999999998 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 1.6299999999999999 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.3799999999999999 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.6100000000000001 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.7000000000000002 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.1000000000000001 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 1.98 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.3799999999999999 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.1100000000000001 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.3200000000000001 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.1299999999999999 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 1.75 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 0.98999999999999999 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HE ' ' HG3' ' A' ' 36' ' ' GLU . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.3399999999999999 110.016 178.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.433 ' HG3' ' HE ' ' A' ' 35' ' ' ARG . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.45 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 1.45 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.8700000000000001 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 0.88 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.70999999999999996 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 1.47 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 0.93000000000000005 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 0.98999999999999999 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.2000000000000002 110.3 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.23 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 1.8799999999999999 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 0.83999999999999997 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.1000000000000001 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.46 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 4.7199999999999998 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77000000000000002 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.592 ' CA ' HD11 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.66000000000000003 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.46 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.59 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.45 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.563 HD22 HD13 ' B' ' 56' ' ' LEU . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 0.78000000000000003 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.0800000000000001 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.6599999999999999 113.245 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 4.79 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.3399999999999999 114.015 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo . . . . . 0 N--CA 1.476 0.487 0 CA-C-O 120.889 0.287 . . . . 2.1000000000000001 112.414 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 1.4299999999999999 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 0.81000000000000005 110.617 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 0.60999999999999999 107.61 177.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 1.3200000000000001 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.9399999999999999 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.1399999999999999 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 0.71999999999999997 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.8899999999999999 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 1.46 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.538 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 0.67000000000000004 113.89 -177.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 0.71999999999999997 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.1000000000000001 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.49 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.4299999999999999 110.975 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 0.78000000000000003 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.0800000000000001 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.1200000000000001 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.4 ' HB3' HG22 ' B' ' 30' ' ' VAL . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 1.8799999999999999 110.348 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.501 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.3899999999999999 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.3100000000000001 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.1899999999999999 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.472 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.2999999999999998 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.472 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.0800000000000001 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.408 ' H ' ' HB1' ' B' ' 27' ' ' ALA . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.25 114.186 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 1.75 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.501 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.3500000000000001 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.542 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.5800000000000001 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.27 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.2000000000000002 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.542 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.05 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.54 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.5 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.538 ' HA ' ' HB2' ' B' ' 13' ' ' ALA . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 1.3799999999999999 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.0699999999999998 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 0.91000000000000003 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 0.72999999999999998 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.3999999999999999 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.03 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1000000000000001 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 0.83999999999999997 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.5600000000000001 112.233 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.568 ' HA ' HG22 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.88 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 1.6000000000000001 108.332 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . 0.445 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.586 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.0900000000000001 108.907 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.3900000000000001 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.82999999999999996 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . 0.586 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 0.63 109.969 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.3300000000000001 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.0299999999999998 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.592 HD11 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.21 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 0.98999999999999999 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.0899999999999999 109.099 -176.623 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.461 -0.397 0 CA-C-O 120.99 0.329 . . . . 2.4300000000000002 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.405 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.03 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 0.76000000000000001 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 0.98999999999999999 112.311 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 1.51 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.6699999999999999 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 0.70999999999999996 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 0.68000000000000005 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.3999999999999999 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 1.47 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 0.77000000000000002 112.96 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.3700000000000001 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 0.77000000000000002 109.956 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.3300000000000001 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB2' HD13 ' A' ' 6' ' ' LEU . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 1.3200000000000001 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 1.4399999999999999 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 0.77000000000000002 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.451 HG12 ' HB ' ' A' ' 38' ' ' VAL . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.3799999999999999 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.0800000000000001 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 2.5499999999999998 111.233 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 35' ' ' ARG . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 1.6299999999999999 109.984 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.4 HG12 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.3799999999999999 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.6100000000000001 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.598 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.7000000000000002 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.1000000000000001 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 1.98 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.3799999999999999 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.1100000000000001 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.3200000000000001 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.1299999999999999 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 1.75 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 0.98999999999999999 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.3399999999999999 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.45 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.451 ' HB ' HG12 ' A' ' 20' ' ' VAL . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 1.45 111.971 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.8700000000000001 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 0.88 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 1.47 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 0.93000000000000005 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 0.98999999999999999 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.2000000000000002 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.23 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 1.8799999999999999 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 0.83999999999999997 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.1000000000000001 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 4.7199999999999998 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77000000000000002 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 0.66000000000000003 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.46 112.441 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.45 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.679 HD22 HD13 ' B' ' 56' ' ' LEU . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 0.78000000000000003 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.0800000000000001 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.6599999999999999 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 4.79 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 . . . . . 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.3399999999999999 111.111 -178.638 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.46 -0.457 0 CA-C-O 121.4 0.5 . . . . 2.1000000000000001 112.951 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 1.4299999999999999 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.505 ' O ' HG23 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 0.81000000000000005 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 0.60999999999999999 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 1.3200000000000001 109.548 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.9399999999999999 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.1399999999999999 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 0.71999999999999997 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.8899999999999999 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.455 ' CD1' ' HB2' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 1.46 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 0.67000000000000004 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.493 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 0.71999999999999997 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.1000000000000001 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.49 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.516 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.4299999999999999 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 0.78000000000000003 111.774 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.447 ' CG1' HD22 ' B' ' 6' ' ' LEU . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.0800000000000001 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.546 ' O ' HG12 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.1200000000000001 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 1.8799999999999999 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.3899999999999999 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.546 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.3100000000000001 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.1899999999999999 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.557 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.2999999999999998 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.557 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.0800000000000001 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.25 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 77.2 m80 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 1.75 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.3500000000000001 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.5800000000000001 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.711 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.27 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.2000000000000002 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.05 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.54 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.5 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.493 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 1.3799999999999999 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' B' ' 42' ' ' MET . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.0699999999999998 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 0.91000000000000003 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.455 ' HB2' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.72999999999999998 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.594 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.3999999999999999 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.03 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1000000000000001 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 0.83999999999999997 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.5600000000000001 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.588 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.88 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 1.6000000000000001 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.0900000000000001 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.3900000000000001 110.44 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.82999999999999996 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 0.63 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.3300000000000001 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.0299999999999998 112.262 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 0.98999999999999999 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.0899999999999999 113.792 179.893 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.454 -0.796 0 N-CA-C 110.666 -0.552 . . . . 2.4300000000000002 110.666 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.429 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.03 109.987 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 0.76000000000000001 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.607 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 0.98999999999999999 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 1.51 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.429 ' HB2' HG12 ' A' ' 4' ' ' VAL . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.6699999999999999 109.735 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 0.70999999999999996 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 0.68000000000000005 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.3999999999999999 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 1.47 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 0.77000000000000002 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.3700000000000001 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 0.77000000000000002 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.3300000000000001 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.607 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 1.3200000000000001 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 1.4399999999999999 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 0.77000000000000002 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.435 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.3799999999999999 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.0800000000000001 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HD3' HG23 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 2.5499999999999998 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.607 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 1.6299999999999999 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.3799999999999999 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.515 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.6100000000000001 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.515 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.7000000000000002 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.1000000000000001 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 1.98 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.3799999999999999 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.472 HG23 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.1100000000000001 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.426 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.3200000000000001 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.1299999999999999 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 1.75 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 0.98999999999999999 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.3399999999999999 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.45 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.435 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 1.45 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.8700000000000001 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 0.88 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 0.70999999999999996 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 1.47 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.417 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 0.93000000000000005 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 0.98999999999999999 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.2000000000000002 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.23 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 1.8799999999999999 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 0.83999999999999997 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.1000000000000001 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.464 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 4.7199999999999998 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77000000000000002 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 0.66000000000000003 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.46 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.45 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' B' ' 56' ' ' LEU . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 0.78000000000000003 113.506 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.0800000000000001 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.6599999999999999 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 4.79 112.589 -179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.633 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.3399999999999999 110.191 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.487 0 CA-C-O 121.2 0.417 . . . . 2.1000000000000001 112.814 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 1.4299999999999999 109.77 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 0.81000000000000005 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.489 HD22 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 0.60999999999999999 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 1.3200000000000001 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.9399999999999999 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.1399999999999999 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.634 ' HB2' HG21 ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 0.71999999999999997 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.8899999999999999 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 1.46 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.45 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 0.67000000000000004 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.459 HG21 HG22 ' B' ' 38' ' ' VAL . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 0.71999999999999997 109.506 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.1000000000000001 110.671 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.49 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.4299999999999999 109.456 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 0.78000000000000003 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.634 HG21 ' HB2' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.0800000000000001 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.648 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.1200000000000001 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 1.8799999999999999 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 38' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.3899999999999999 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.3100000000000001 107.32 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.648 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.1899999999999999 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.2999999999999998 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.0800000000000001 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.25 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 1.75 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.3500000000000001 114.032 -179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.5800000000000001 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.27 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.2000000000000002 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.451 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.05 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.54 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.5 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 23' ' ' VAL . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 1.3799999999999999 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.0699999999999998 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 0.91000000000000003 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 0.72999999999999998 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.3999999999999999 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.03 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1000000000000001 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 0.83999999999999997 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.5600000000000001 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.88 112.046 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 1.6000000000000001 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.0900000000000001 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.612 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.3900000000000001 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.82999999999999996 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 0.63 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.3300000000000001 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.612 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.0299999999999998 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' A' ' 56' ' ' LEU . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.21 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 0.98999999999999999 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.0899999999999999 110.107 179.484 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo . . . . . 0 N--CA 1.456 -0.732 0 CA-C-O 121.287 0.453 . . . . 2.4300000000000002 111.913 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.03 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 0.76000000000000001 110.614 178.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 0.98999999999999999 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 1.51 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.6699999999999999 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' THR . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 0.70999999999999996 109.588 177.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 0.68000000000000005 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.3999999999999999 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 1.47 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 0.77000000000000002 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.3700000000000001 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 0.77000000000000002 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.3300000000000001 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.451 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 1.3200000000000001 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 tp-100 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 1.4399999999999999 109.972 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 0.77000000000000002 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 24' ' ' VAL . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.3799999999999999 111.223 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.0800000000000001 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HE ' HG23 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 2.5499999999999998 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.624 ' HB ' HG11 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 1.6299999999999999 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.3799999999999999 109.947 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.6100000000000001 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.7000000000000002 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.1000000000000001 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 1.98 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.3799999999999999 109.216 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG23 ' HE ' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.1100000000000001 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.432 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.3200000000000001 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.1299999999999999 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 1.75 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 0.98999999999999999 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 35' ' ' ARG . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.3399999999999999 110.843 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.45 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.624 HG11 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 1.45 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' MET . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.8700000000000001 111.237 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 0.88 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 0.70999999999999996 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' GLU . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 1.47 111.11 -178.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 0.93000000000000005 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 0.98999999999999999 110.71 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.2000000000000002 110.512 -179.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.23 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.427 HD12 ' HD2' ' A' ' 49' ' ' PRO . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 1.8799999999999999 109.882 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 48' ' ' ILE . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 0.83999999999999997 113.453 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.1000000000000001 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 4.7199999999999998 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77000000000000002 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 0.66000000000000003 109.242 178.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.46 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.45 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' B' ' 56' ' ' LEU . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 0.78000000000000003 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.0800000000000001 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.6599999999999999 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 4.79 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.54 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.3399999999999999 110.212 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 C--O 1.223 -0.258 0 CA-C-O 120.57 0.154 . . . . 2.1000000000000001 112.291 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 1.4299999999999999 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 0.81000000000000005 111.842 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 0.60999999999999999 108.725 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 1.3200000000000001 109.941 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.9399999999999999 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.1399999999999999 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 0.71999999999999997 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.8899999999999999 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 1.46 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 0.67000000000000004 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 0.71999999999999997 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.1000000000000001 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.49 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.4299999999999999 111.299 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 0.78000000000000003 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.0800000000000001 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.1200000000000001 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 1.8799999999999999 110.279 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.3899999999999999 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.3100000000000001 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.1899999999999999 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.2999999999999998 111.241 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.0800000000000001 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.25 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 1.75 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.3500000000000001 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.5800000000000001 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.27 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.2000000000000002 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.05 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.54 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.5 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 1.3799999999999999 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.0699999999999998 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 0.91000000000000003 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 0.72999999999999998 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.3999999999999999 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.03 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1000000000000001 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 0.83999999999999997 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.5600000000000001 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.88 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 1.6000000000000001 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.466 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.0900000000000001 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.3900000000000001 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.82999999999999996 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.63 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.3300000000000001 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.0299999999999998 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' A' ' 56' ' ' LEU . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.21 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 0.98999999999999999 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.0899999999999999 111.539 -178.701 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 C--O 1.235 0.33 0 N-CA-C 111.176 -0.355 . . . . 2.4300000000000002 111.176 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.563 HG12 ' HB2' ' A' ' 8' ' ' ASP . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.03 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 0.76000000000000001 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.493 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 0.98999999999999999 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 1.51 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.563 ' HB2' HG12 ' A' ' 4' ' ' VAL . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.6699999999999999 109.385 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 0.70999999999999996 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 0.68000000000000005 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.3999999999999999 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 1.47 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 0.77000000000000002 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.3700000000000001 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 0.77000000000000002 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.3300000000000001 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.493 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 1.3200000000000001 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 1.4399999999999999 110.254 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 0.77000000000000002 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.505 ' O ' HG23 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.3799999999999999 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.0800000000000001 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 2.5499999999999998 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.444 HG21 ' CG2' ' A' ' 38' ' ' VAL . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 1.6299999999999999 110.527 -178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.3799999999999999 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.6100000000000001 109.874 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.7000000000000002 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.1000000000000001 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 1.98 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.3799999999999999 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.1100000000000001 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.3200000000000001 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.1299999999999999 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 1.75 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 0.98999999999999999 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.3399999999999999 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.45 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.444 ' CG2' HG21 ' A' ' 23' ' ' VAL . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 1.45 110.899 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.8700000000000001 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 0.88 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 0.70999999999999996 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 1.47 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 0.93000000000000005 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HB3' HG11 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 0.98999999999999999 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.2000000000000002 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.23 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 1.8799999999999999 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 0.83999999999999997 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.1000000000000001 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 4.7199999999999998 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77000000000000002 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 0.66000000000000003 110.096 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.46 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.45 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.481 HD22 HD13 ' B' ' 56' ' ' LEU . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 0.78000000000000003 112.076 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.0800000000000001 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.6599999999999999 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 54' ' ' GLN . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 4.79 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.3399999999999999 111.918 -178.787 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 N--CA 1.454 -0.811 0 N-CA-C 111.175 -0.356 . . . . 2.1000000000000001 111.175 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 1.4299999999999999 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.65 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 0.81000000000000005 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 6' ' ' LEU . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.60999999999999999 109.92 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 1.3200000000000001 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.9399999999999999 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.1399999999999999 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 0.71999999999999997 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.8899999999999999 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 1.46 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 0.67000000000000004 112.429 -178.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 0.71999999999999997 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . 0.425 ' HB2' ' OG1' ' B' ' 19' ' ' THR . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.1000000000000001 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.49 112.8 -178.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.4299999999999999 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 0.78000000000000003 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.0800000000000001 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.1200000000000001 110.66 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 1.8799999999999999 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.573 HG22 HG11 ' B' ' 30' ' ' VAL . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.3899999999999999 110.537 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.3100000000000001 112.682 -178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.457 ' CG ' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.1899999999999999 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.457 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.2999999999999998 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.0800000000000001 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.25 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 1.75 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.573 HG11 HG22 ' B' ' 23' ' ' VAL . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.3500000000000001 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.499 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.5800000000000001 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.27 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.2000000000000002 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.05 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.54 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.5 111.943 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 1.3799999999999999 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.0699999999999998 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.91000000000000003 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 0.72999999999999998 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.3999999999999999 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.03 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1000000000000001 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.83999999999999997 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.5600000000000001 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.88 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.404 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 1.6000000000000001 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.0900000000000001 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.3900000000000001 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.82999999999999996 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 0.63 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.3300000000000001 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.0299999999999998 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.21 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 0.98999999999999999 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . . . . . . 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.0899999999999999 114.447 178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo . . . . . 0 C--O 1.236 0.393 0 CA-C-O 120.834 0.264 . . . . 2.4300000000000002 111.631 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.03 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 0.76000000000000001 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.665 HD22 ' OG ' ' A' ' 21' ' ' SER . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 0.98999999999999999 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 1.51 110.368 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.6699999999999999 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 0.70999999999999996 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 0.68000000000000005 112.015 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.3999999999999999 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 1.47 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 0.77000000000000002 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.3700000000000001 111.558 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 0.77000000000000002 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.3300000000000001 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 1.3200000000000001 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 1.4399999999999999 112.286 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 0.77000000000000002 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.3799999999999999 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.665 ' OG ' HD22 ' A' ' 6' ' ' LEU . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.0800000000000001 113.376 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 22' ' ' ARG . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 2.5499999999999998 111.727 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 38' ' ' VAL . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 1.6299999999999999 110.55 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 49' ' ' PRO . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.3799999999999999 110.805 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.6100000000000001 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.7000000000000002 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.1000000000000001 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 1.98 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.3799999999999999 108.264 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.1100000000000001 111.865 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.3200000000000001 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.1299999999999999 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 1.75 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 0.98999999999999999 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.3399999999999999 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.45 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 23' ' ' VAL . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 1.45 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.8700000000000001 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 0.88 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 0.70999999999999996 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 1.47 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 0.93000000000000005 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 0.98999999999999999 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.2000000000000002 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.553 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.23 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 1.8799999999999999 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.409 ' HB3' HG11 ' A' ' 24' ' ' VAL . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 0.83999999999999997 111.804 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.1000000000000001 110.169 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 4.7199999999999998 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77000000000000002 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.426 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 0.66000000000000003 110.694 178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.46 112.742 -178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.45 110.25 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.669 HD22 HD13 ' B' ' 56' ' ' LEU . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 0.78000000000000003 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.0800000000000001 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.6599999999999999 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 4.79 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.5 OUTLIER . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.3399999999999999 113.339 179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.415 ' O ' HG22 ' B' ' 4' ' ' VAL . 87.4 Cg_endo . . . . . 0 N--CA 1.463 -0.286 0 N-CA-C 112.325 0.086 . . . . 2.1000000000000001 112.325 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.631 HG22 ' HA ' ' B' ' 47' ' ' TYR . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 1.4299999999999999 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.406 ' N ' HG23 ' B' ' 4' ' ' VAL . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 0.81000000000000005 110.005 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.57 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 0.60999999999999999 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 1.3200000000000001 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.9399999999999999 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.1399999999999999 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 0.71999999999999997 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.8899999999999999 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 1.46 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 0.67000000000000004 112.337 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 0.71999999999999997 109.991 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.1000000000000001 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.444 ' O ' HG12 ' B' ' 20' ' ' VAL . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.49 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.406 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.4299999999999999 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 0.78000000000000003 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.444 HG12 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.0800000000000001 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.1200000000000001 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 1.8799999999999999 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' B' ' 35' ' ' ARG . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.3899999999999999 109.538 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.3100000000000001 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.1899999999999999 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.2999999999999998 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.0800000000000001 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.25 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 1.75 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.466 HG11 HG22 ' B' ' 23' ' ' VAL . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.3500000000000001 109.831 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . 0.514 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.5800000000000001 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.27 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.2000000000000002 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.05 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.54 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.5 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 1.3799999999999999 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.0699999999999998 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 0.91000000000000003 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 0.72999999999999998 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.3999999999999999 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.03 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1000000000000001 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 0.83999999999999997 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.5600000000000001 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.631 ' HA ' HG22 ' B' ' 4' ' ' VAL . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.88 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 1.6000000000000001 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.0900000000000001 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.3900000000000001 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.82999999999999996 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 0.63 109.916 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.658 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.3300000000000001 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.0299999999999998 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.669 HD13 HD22 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.21 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 0.98999999999999999 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.0899999999999999 113.787 177.863 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 C--O 1.234 0.323 0 N-CA-C 111.18 -0.354 . . . . 2.4300000000000002 111.18 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.03 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.419 ' O ' HG23 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 0.76000000000000001 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 0.98999999999999999 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 1.51 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.6699999999999999 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 0.70999999999999996 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 0.68000000000000005 111.149 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.3999999999999999 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.47 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 0.77000000000000002 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.3700000000000001 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 0.77000000000000002 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.3300000000000001 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.498 ' O ' HD12 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 1.3200000000000001 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 1.4399999999999999 110.478 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 0.77000000000000002 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.3799999999999999 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.456 ' HA ' HG23 ' A' ' 24' ' ' VAL . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.0800000000000001 111.364 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 2.5499999999999998 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 1.6299999999999999 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.486 HG13 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.3799999999999999 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.6100000000000001 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.551 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.7000000000000002 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.1000000000000001 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 1.98 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.3799999999999999 112.343 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.1100000000000001 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.3200000000000001 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.1299999999999999 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 1.75 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 0.98999999999999999 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.3399999999999999 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.45 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 1.45 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.8700000000000001 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 0.88 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 0.70999999999999996 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 1.47 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 0.93000000000000005 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 0.98999999999999999 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.2000000000000002 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.23 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 1.8799999999999999 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 0.83999999999999997 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.1000000000000001 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 4.7199999999999998 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77000000000000002 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 0.66000000000000003 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.46 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.45 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.547 HD22 HD13 ' B' ' 56' ' ' LEU . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 0.78000000000000003 111.827 178.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.0800000000000001 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.6599999999999999 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 4.79 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.3399999999999999 111.304 178.819 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.457 -0.655 0 CA-C-O 121.446 0.519 . . . . 2.1000000000000001 111.938 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 1.4299999999999999 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.517 ' O ' HG23 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 0.81000000000000005 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 0.60999999999999999 110.155 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 1.3200000000000001 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.9399999999999999 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.1399999999999999 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . 0.453 ' HA ' HG21 ' B' ' 20' ' ' VAL . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 0.71999999999999997 112.077 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.8899999999999999 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 1.46 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 0.67000000000000004 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 0.71999999999999997 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.1000000000000001 112.6 -178.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.49 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.4299999999999999 111.509 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.422 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 0.78000000000000003 111.856 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.453 HG21 ' HA ' ' B' ' 10' ' ' ALA . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.0800000000000001 111.255 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.1200000000000001 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.576 ' HG2' ' HB3' ' B' ' 27' ' ' ALA . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 1.8799999999999999 111.156 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 19' ' ' THR . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.3899999999999999 108.309 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.3100000000000001 110.436 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.1899999999999999 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.2999999999999998 113.139 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.576 ' HB3' ' HG2' ' B' ' 22' ' ' ARG . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.0800000000000001 112.187 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.25 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 1.75 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 27' ' ' ALA . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.3500000000000001 109.696 175.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.5800000000000001 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.422 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.27 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.2000000000000002 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG13 ' B' ' 38' ' ' VAL . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.05 112.661 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.422 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.54 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.5 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.408 HG13 ' O ' ' B' ' 34' ' ' THR . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 1.3799999999999999 110.685 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.0699999999999998 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 0.91000000000000003 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 0.72999999999999998 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.3999999999999999 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.03 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1000000000000001 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 0.83999999999999997 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.5600000000000001 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.88 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 1.6000000000000001 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.705 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.0900000000000001 109.162 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.48 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.3900000000000001 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.82999999999999996 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 0.63 111.569 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.3300000000000001 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.0299999999999998 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.21 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 0.98999999999999999 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.0899999999999999 111.381 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo . . . . . 0 N--CA 1.455 -0.77 0 CA-C-O 121.192 0.414 . . . . 2.4300000000000002 111.667 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 4' ' ' VAL . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.03 108.983 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 0.76000000000000001 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 0.98999999999999999 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 1.51 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.6699999999999999 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 0.70999999999999996 110.504 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 0.68000000000000005 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.3999999999999999 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 1.47 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 0.77000000000000002 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.3700000000000001 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.489 HG11 ' CG2' ' A' ' 34' ' ' THR . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 0.77000000000000002 110.02 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.3300000000000001 110.895 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.587 ' HB2' HD12 ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 1.3200000000000001 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 8.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 1.4399999999999999 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 0.77000000000000002 110.381 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.693 ' O ' HG22 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.3799999999999999 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.0800000000000001 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 2.5499999999999998 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 1.6299999999999999 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.3799999999999999 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.6100000000000001 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.7000000000000002 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.1000000000000001 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 1.98 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.3799999999999999 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.1100000000000001 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.3200000000000001 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.1299999999999999 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 1.75 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.489 ' CG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 0.98999999999999999 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.3399999999999999 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.45 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 1.45 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.8700000000000001 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 0.88 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 0.70999999999999996 111.851 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 1.47 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 0.93000000000000005 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 0.98999999999999999 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.2000000000000002 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.23 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 1.8799999999999999 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.631 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 0.83999999999999997 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.1000000000000001 109.464 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.64 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 4.7199999999999998 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77000000000000002 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 0.66000000000000003 112.566 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.46 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.45 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.829 HD22 HD13 ' B' ' 56' ' ' LEU . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 0.78000000000000003 111.129 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.0800000000000001 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.6599999999999999 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 4.79 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.3399999999999999 111.234 -179.649 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.529 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo . . . . . 0 N--CA 1.45 -1.082 0 CA-C-O 120.745 0.227 . . . . 2.1000000000000001 111.538 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 1.4299999999999999 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 0.81000000000000005 110.572 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 0.60999999999999999 109.035 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 1.3200000000000001 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.9399999999999999 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.422 ' H ' HG23 ' B' ' 9' ' ' VAL . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.1399999999999999 110.652 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.71999999999999997 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.8899999999999999 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 1.46 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 0.67000000000000004 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 0.71999999999999997 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.1000000000000001 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.49 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.4299999999999999 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 0.78000000000000003 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.0800000000000001 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.629 ' O ' HG12 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.1200000000000001 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.456 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 1.8799999999999999 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.3899999999999999 110.755 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.629 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.3100000000000001 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.1899999999999999 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.2999999999999998 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . 0.513 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.0800000000000001 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.444 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.25 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . 0.413 ' HB2' ' O ' ' B' ' 28' ' ' SER . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 1.75 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 27' ' ' ALA . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.3500000000000001 110.968 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.5800000000000001 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.27 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.2000000000000002 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.05 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.54 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.5 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 1.3799999999999999 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.0699999999999998 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 0.91000000000000003 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 0.72999999999999998 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.3999999999999999 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.03 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1000000000000001 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 0.83999999999999997 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.5600000000000001 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.88 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.529 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 1.6000000000000001 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.0900000000000001 108.029 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.3900000000000001 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.82999999999999996 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 0.63 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.3300000000000001 111.949 -179.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.0299999999999998 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.829 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.21 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 0.98999999999999999 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.0899999999999999 113.997 -177.602 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 N-CA-C 111.248 -0.328 . . . . 2.4300000000000002 111.248 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.03 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 0.76000000000000001 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 0.98999999999999999 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 1.51 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.6699999999999999 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 0.70999999999999996 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 0.68000000000000005 111.71 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.3999999999999999 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 1.47 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 0.77000000000000002 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.3700000000000001 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 0.77000000000000002 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.3300000000000001 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HB2' HD12 ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 1.3200000000000001 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 5.6 tp-100 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 1.4399999999999999 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG11 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 0.77000000000000002 112.142 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.3799999999999999 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.0800000000000001 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 2.5499999999999998 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 1.6299999999999999 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.3799999999999999 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.6100000000000001 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.7000000000000002 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.1000000000000001 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 1.98 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.3799999999999999 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 HH11 ' A' ' 22' ' ' ARG . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.1100000000000001 111.029 -178.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.3200000000000001 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.1299999999999999 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 1.75 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 0.98999999999999999 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.3399999999999999 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.45 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.442 HG23 HG11 ' A' ' 23' ' ' VAL . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 1.45 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.8700000000000001 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 0.88 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 0.70999999999999996 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.445 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 1.47 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 0.93000000000000005 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.478 ' O ' HG21 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 0.98999999999999999 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.2000000000000002 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.23 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 1.8799999999999999 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 0.83999999999999997 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.481 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.1000000000000001 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 4.7199999999999998 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77000000000000002 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 0.66000000000000003 111.132 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.46 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 27.9 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.45 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.624 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 0.78000000000000003 111.762 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.0800000000000001 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.6599999999999999 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 4.79 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.41 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 23.4 mp0 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.3399999999999999 111.548 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 N--CA 1.451 -0.98 0 CA-C-O 121.283 0.451 . . . . 2.1000000000000001 112.732 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.407 ' H ' HG12 ' B' ' 4' ' ' VAL . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 1.4299999999999999 108.609 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 0.81000000000000005 111.593 -178.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 0.60999999999999999 108.366 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 1.3200000000000001 109.501 177.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.9399999999999999 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.1399999999999999 109.956 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 0.71999999999999997 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.8899999999999999 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 1.46 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 0.67000000000000004 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.459 HG11 HG23 ' B' ' 34' ' ' THR . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 0.71999999999999997 109.648 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.1000000000000001 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.49 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.4299999999999999 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.427 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 0.78000000000000003 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.568 ' O ' HG12 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.0800000000000001 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.1200000000000001 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.427 ' NH1' HG23 ' B' ' 19' ' ' THR . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 1.8799999999999999 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.568 HG12 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.3899999999999999 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.3100000000000001 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.1899999999999999 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.2999999999999998 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.0800000000000001 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.25 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 45.4 m80 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 1.75 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.3500000000000001 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.5800000000000001 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.27 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.2000000000000002 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.459 HG23 HG11 ' B' ' 15' ' ' VAL . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.05 110.367 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.54 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.5 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 1.3799999999999999 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.0699999999999998 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.91000000000000003 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 0.72999999999999998 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.3999999999999999 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.03 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1000000000000001 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 0.83999999999999997 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.5600000000000001 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.88 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 1.6000000000000001 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.705 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.0900000000000001 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.429 ' O ' ' HD3' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.3900000000000001 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.82999999999999996 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 0.63 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.705 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.3300000000000001 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.0299999999999998 111.676 -178.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.624 HD13 HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.21 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 0.98999999999999999 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.0899999999999999 113.469 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo . . . . . 0 C--O 1.239 0.533 0 CA-C-O 121.206 0.419 . . . . 2.4300000000000002 111.934 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 0.76000000000000001 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.416 HD22 ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 0.98999999999999999 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 1.51 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.6699999999999999 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.441 ' H ' HG23 ' A' ' 9' ' ' VAL . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.70999999999999996 109.13 177.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 0.68000000000000005 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.3999999999999999 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 1.47 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 0.77000000000000002 111.945 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.3700000000000001 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 13' ' ' ALA . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 0.77000000000000002 110.047 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.3300000000000001 110.499 178.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB2' HD22 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 1.3200000000000001 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 1.4399999999999999 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 0.77000000000000002 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.3799999999999999 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.434 ' HA ' HG22 ' A' ' 24' ' ' VAL . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.0800000000000001 110.593 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 2.5499999999999998 110.328 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 1.6299999999999999 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 21' ' ' SER . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.3799999999999999 111.044 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.6100000000000001 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.7000000000000002 112.647 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.1000000000000001 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 1.98 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.3799999999999999 110.044 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.1100000000000001 109.813 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.515 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.3200000000000001 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.1299999999999999 112.162 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 1.75 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 0.98999999999999999 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.3399999999999999 110.757 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.45 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 1.45 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.8700000000000001 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.88 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 0.70999999999999996 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 1.47 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 0.93000000000000005 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.98999999999999999 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.2000000000000002 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.23 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 1.8799999999999999 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 0.83999999999999997 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.1000000000000001 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.477 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 4.7199999999999998 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.461 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77000000000000002 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 0.66000000000000003 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.46 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.45 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 0.78000000000000003 109.487 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.0800000000000001 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.6599999999999999 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 4.79 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.3399999999999999 108.701 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.441 -1.596 0 N-CA-C 113.032 0.359 . . . . 2.1000000000000001 113.032 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 1.4299999999999999 109.209 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 0.81000000000000005 111.399 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 0.60999999999999999 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 1.3200000000000001 108.546 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.9399999999999999 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.1399999999999999 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 0.71999999999999997 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.8899999999999999 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.426 ' HB2' HD11 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 1.46 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 0.67000000000000004 111.433 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 0.71999999999999997 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.1000000000000001 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.49 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.4299999999999999 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.407 ' HA ' ' HB2' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 0.78000000000000003 111.072 -179.346 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.0800000000000001 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.1200000000000001 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' B' ' 19' ' ' THR . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 1.8799999999999999 111.802 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.701 HG11 HG21 ' B' ' 38' ' ' VAL . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.3899999999999999 109.32 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.3100000000000001 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.1899999999999999 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.2999999999999998 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.0800000000000001 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.25 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.0 m80 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 1.75 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.3500000000000001 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.5800000000000001 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.27 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.2000000000000002 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.05 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.54 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.5 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.701 HG21 HG11 ' B' ' 23' ' ' VAL . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 1.3799999999999999 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.0699999999999998 110.202 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 0.91000000000000003 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 0.72999999999999998 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.3999999999999999 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.03 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1000000000000001 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 0.83999999999999997 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.5600000000000001 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.451 ' HA ' HG22 ' B' ' 4' ' ' VAL . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.88 110.65 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 1.6000000000000001 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.559 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.0900000000000001 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.3900000000000001 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.559 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.82999999999999996 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 0.63 110.711 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.3300000000000001 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.0299999999999998 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.21 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 0.98999999999999999 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.0899999999999999 114.379 179.749 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo . . . . . 0 N--CA 1.459 -0.558 0 CA-C-O 121.015 0.34 . . . . 2.4300000000000002 112.073 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.03 108.632 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.477 ' O ' HG23 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 0.76000000000000001 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.455 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 0.98999999999999999 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 1.51 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.6699999999999999 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 0.70999999999999996 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.68000000000000005 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.3999999999999999 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 1.47 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 0.77000000000000002 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.3700000000000001 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 0.77000000000000002 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.3300000000000001 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.455 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 1.3200000000000001 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 1.4399999999999999 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 0.77000000000000002 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.604 ' O ' HG22 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.3799999999999999 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.0800000000000001 113.321 -178.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.48 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 2.5499999999999998 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 1.6299999999999999 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.3799999999999999 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.6100000000000001 113.037 -178.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.7000000000000002 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.1000000000000001 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 1.98 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.3799999999999999 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.48 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.1100000000000001 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.3200000000000001 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.1299999999999999 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 1.75 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 0.98999999999999999 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.3399999999999999 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.45 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.432 ' HB ' HG12 ' A' ' 20' ' ' VAL . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 1.45 112.175 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.8700000000000001 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 0.88 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 0.70999999999999996 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.618 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 1.47 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 0.93000000000000005 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 0.98999999999999999 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.2000000000000002 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.23 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 1.8799999999999999 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 0.83999999999999997 111.905 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.1000000000000001 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 4.7199999999999998 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77000000000000002 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.579 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 0.66000000000000003 112.257 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.568 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.46 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.45 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.753 HD22 HD13 ' B' ' 56' ' ' LEU . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 0.78000000000000003 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.0800000000000001 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.6599999999999999 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 4.79 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.3399999999999999 112.893 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo . . . . . 0 N--CA 1.448 -1.152 0 CA-C-O 120.962 0.318 . . . . 2.1000000000000001 112.154 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 1.4299999999999999 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 0.81000000000000005 111.699 -177.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' B' ' 6' ' ' LEU . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 0.60999999999999999 108.695 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 1.3200000000000001 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.9399999999999999 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.1399999999999999 110.632 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 0.71999999999999997 111.625 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.8899999999999999 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 1.46 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 0.67000000000000004 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 0.71999999999999997 110.331 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.1000000000000001 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.49 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.513 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.4299999999999999 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.78000000000000003 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.0800000000000001 111.179 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.1200000000000001 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 1.8799999999999999 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.517 HG11 ' HB ' ' B' ' 38' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.3899999999999999 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.3100000000000001 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.1899999999999999 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.2999999999999998 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.0800000000000001 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.25 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 1.75 109.744 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.466 ' CG1' HG22 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.3500000000000001 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.5800000000000001 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . 0.681 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.27 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.501 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.2000000000000002 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.05 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.681 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.54 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.501 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.5 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.517 ' HB ' HG11 ' B' ' 23' ' ' VAL . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 1.3799999999999999 112.14 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.0699999999999998 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 0.91000000000000003 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 0.72999999999999998 110.476 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.3999999999999999 110.554 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.03 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1000000000000001 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 0.83999999999999997 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.5600000000000001 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.88 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 1.6000000000000001 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.0900000000000001 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.3900000000000001 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.42 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.82999999999999996 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 0.63 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.3300000000000001 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.0299999999999998 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.21 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.0899999999999999 112.715 -178.96 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 CA--C 1.53 0.293 0 CA-C-O 121.021 0.342 . . . . 2.4300000000000002 112.05 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.03 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 0.76000000000000001 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 0.98999999999999999 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 1.51 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.474 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.6699999999999999 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 0.70999999999999996 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 0.68000000000000005 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.3999999999999999 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 1.47 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 0.77000000000000002 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.3700000000000001 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 0.77000000000000002 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.3300000000000001 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 1.3200000000000001 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 1.4399999999999999 110.687 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 0.77000000000000002 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.3799999999999999 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.0800000000000001 111.974 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 2.5499999999999998 111.023 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 1.6299999999999999 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.3799999999999999 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.6100000000000001 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.7000000000000002 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.1000000000000001 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 1.98 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.3799999999999999 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.1100000000000001 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.3200000000000001 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.1299999999999999 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 1.75 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 0.98999999999999999 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.596 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.3399999999999999 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.45 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 1.45 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.8700000000000001 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 0.88 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.70999999999999996 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 1.47 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 0.93000000000000005 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 0.98999999999999999 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.2000000000000002 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.23 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 1.8799999999999999 109.994 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 0.83999999999999997 112.606 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.1000000000000001 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 4.7199999999999998 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77000000000000002 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 0.66000000000000003 109.762 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.46 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.474 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.45 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.712 HD22 HD13 ' B' ' 56' ' ' LEU . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 0.78000000000000003 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.0800000000000001 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.6599999999999999 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 4.79 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.3399999999999999 110.977 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo . . . . . 0 N--CA 1.471 0.199 0 CA-C-O 120.759 0.233 . . . . 2.1000000000000001 111.688 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 1.4299999999999999 111.442 -178.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . 0.415 ' O ' HG23 ' B' ' 9' ' ' VAL . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 0.81000000000000005 110.236 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 0.60999999999999999 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 1.3200000000000001 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.9399999999999999 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.419 HG23 ' H ' ' B' ' 9' ' ' VAL . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.1399999999999999 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 0.71999999999999997 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.8899999999999999 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . 0.424 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 1.46 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 0.67000000000000004 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 0.71999999999999997 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.1000000000000001 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . 0.432 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.49 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.4299999999999999 111.828 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 0.78000000000000003 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.0800000000000001 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.1200000000000001 110.619 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 1.8799999999999999 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.69 HG11 HG21 ' B' ' 38' ' ' VAL . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.3899999999999999 110.183 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.3100000000000001 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.1899999999999999 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.2999999999999998 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.0800000000000001 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.25 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 52.5 m80 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 1.75 115.364 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.443 HG13 ' CB ' ' B' ' 22' ' ' ARG . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.3500000000000001 111.315 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.5800000000000001 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.27 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.2000000000000002 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.05 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.54 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.5 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.69 HG21 HG11 ' B' ' 23' ' ' VAL . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 1.3799999999999999 111.231 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.0699999999999998 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 0.91000000000000003 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.72999999999999998 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.3999999999999999 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.03 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1000000000000001 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 0.83999999999999997 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.5600000000000001 112.02 -178.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . 0.41 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.88 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 1.6000000000000001 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.428 ' O ' ' HB3' ' B' ' 54' ' ' GLN . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.0900000000000001 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.3900000000000001 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.82999999999999996 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 0.63 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.3300000000000001 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.568 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.0299999999999998 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.712 HD13 HD22 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.21 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 0.98999999999999999 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.0899999999999999 112.445 174.435 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo . . . . . 0 C--O 1.236 0.375 0 CA-C-O 121.169 0.404 . . . . 2.4300000000000002 112.765 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.03 108.898 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 0.76000000000000001 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 0.98999999999999999 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 1.51 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.482 ' HB2' HG12 ' A' ' 4' ' ' VAL . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.6699999999999999 109.98 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.461 ' HB ' HG21 ' A' ' 20' ' ' VAL . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 0.70999999999999996 110.774 179.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.68000000000000005 110.913 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.3999999999999999 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.56 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 1.47 110.165 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.58 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 0.77000000000000002 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.3700000000000001 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 0.77000000000000002 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.3300000000000001 109.753 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.428 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 1.3200000000000001 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 1.4399999999999999 110.182 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 0.77000000000000002 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG21 ' HB ' ' A' ' 9' ' ' VAL . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.3799999999999999 110.564 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.0800000000000001 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 2.5499999999999998 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 1.6299999999999999 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.3799999999999999 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.6100000000000001 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.7000000000000002 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.1000000000000001 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 1.98 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.3799999999999999 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.1100000000000001 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.3200000000000001 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.1299999999999999 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 1.75 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 0.98999999999999999 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.3399999999999999 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.58 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.45 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 1.45 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.8700000000000001 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 0.88 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.56 ' HB1' ' HD2' ' A' ' 12' ' ' TYR . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 0.70999999999999996 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 1.47 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 0.93000000000000005 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 0.98999999999999999 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.2000000000000002 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.23 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 1.8799999999999999 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 0.83999999999999997 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.1000000000000001 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 4.7199999999999998 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77000000000000002 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.447 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.66000000000000003 109.619 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.46 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.682 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.45 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.657 HD22 HD13 ' B' ' 56' ' ' LEU . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 0.78000000000000003 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.0800000000000001 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.411 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.6599999999999999 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.682 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 4.79 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HG3' ' HB3' ' A' ' 55' ' ' GLN . 5.0 mt-30 . . . . . 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.3399999999999999 110.448 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo . . . . . 0 N--CA 1.458 -0.566 0 CA-C-O 121.635 0.598 . . . . 2.1000000000000001 113.099 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 1.4299999999999999 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 0.81000000000000005 110.394 -177.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.52 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 0.60999999999999999 108.956 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 1.3200000000000001 109.689 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.9399999999999999 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' VAL . . . . . 0.44 ' H ' HG23 ' B' ' 9' ' ' VAL . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.1399999999999999 111.698 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 0.71999999999999997 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.8899999999999999 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 1.46 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 0.67000000000000004 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 0.71999999999999997 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' SER . . . . . 0.465 ' O ' HG23 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.1000000000000001 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.49 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.502 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.4299999999999999 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 0.78000000000000003 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.0800000000000001 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.1200000000000001 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 1.8799999999999999 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . 0.443 HG22 HG11 ' B' ' 30' ' ' VAL . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.3899999999999999 109.961 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.3100000000000001 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.1899999999999999 110.993 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.2999999999999998 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.0800000000000001 113.117 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.25 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 1.75 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.443 HG11 HG22 ' B' ' 23' ' ' VAL . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.3500000000000001 109.849 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.5800000000000001 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.27 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.2000000000000002 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.05 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.54 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.5 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 1.3799999999999999 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.0699999999999998 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 0.91000000000000003 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 0.72999999999999998 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.3999999999999999 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.03 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1000000000000001 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' B' ' 46' ' ' ASN . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 0.83999999999999997 112.021 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 45' ' ' LEU . 32.4 t30 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.5600000000000001 110.76 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.88 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.4 HD11 HD21 ' B' ' 46' ' ' ASN . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 1.6000000000000001 107.421 178.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ASN . . . . . 0.473 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.0900000000000001 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.3900000000000001 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' CYS . . . . . 0.473 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.82999999999999996 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 0.63 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.3300000000000001 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.0299999999999998 110.695 -179.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.657 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.21 109.753 179.463 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 0.98999999999999999 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.0899999999999999 111.167 -179.841 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.63 0.252 . . . . 5.7999999999999998 110.572 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 47.6 tttt -75.55 121.44 85.13 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.265 -0.425 . . . . 5.3499999999999996 110.701 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 9.0 Cg_exo -69.19 102.88 0.98 Allowed 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 121.843 1.695 . . . . 2.4300000000000002 110.2 177.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.3 t -65.26 157.0 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 N-CA-C 109.355 -0.609 . . . . 1.03 109.355 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 45.8 p -136.37 171.37 14.58 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-O 121.008 0.432 . . . . 0.76000000000000001 110.036 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.459 ' HB2' ' CG2' ' A' ' 20' ' ' VAL . 2.2 pp -64.45 -20.34 66.11 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.704 -0.68 . . . . 0.98999999999999999 110.537 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -68.78 -35.95 77.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.113 -0.699 . . . . 1.51 109.113 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -68.85 -46.88 67.37 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.368 -0.833 . . . . 1.6699999999999999 109.191 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 48.4 t -63.9 -49.75 80.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 115.239 -0.891 . . . . 0.70999999999999996 112.006 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.445 ' CB ' ' HA ' ' A' ' 17' ' ' TYR . . . -61.55 -46.12 91.29 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.565 0.209 . . . . 0.68000000000000005 111.565 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -58.53 -47.17 85.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.668 0.27 . . . . 2.3999999999999999 110.964 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -64.22 -44.52 91.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 1.47 111.159 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.491 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -67.27 -28.37 67.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.385 -0.37 . . . . 0.77000000000000002 111.754 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.45 36.28 7.55 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 120.788 -0.72 . . . . 1.3700000000000001 111.745 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -134.85 -179.3 3.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.136 0.493 . . . . 0.77000000000000002 110.283 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 98.8 p -80.97 140.58 35.14 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.853 -0.612 . . . . 1.3300000000000001 110.454 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ALA . 27.8 p90 -48.38 -9.81 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.113 1.153 . . . . 1.3200000000000001 114.113 178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -90.29 -41.4 11.56 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.575 -0.703 . . . . 1.4399999999999999 110.588 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.7 m -45.35 -35.74 3.74 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.136 0.791 . . . . 0.77000000000000002 113.136 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.71 HG12 HG13 ' A' ' 38' ' ' VAL . 19.4 m -77.31 -22.45 14.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 CA-C-O 120.928 0.394 . . . . 1.3799999999999999 111.495 179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 t -80.63 -30.04 36.74 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.799 -0.637 . . . . 1.0800000000000001 110.864 -177.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -74.48 -23.94 58.94 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.988 -0.551 . . . . 2.5499999999999998 111.735 -178.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 20' ' ' VAL . 10.2 m -83.11 -26.2 7.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.354 0.597 . . . . 1.6299999999999999 110.725 -177.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 20' ' ' VAL . 32.6 t -78.07 -22.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.334 -0.848 . . . . 1.3799999999999999 112.604 -178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -107.74 -56.23 2.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.976 0.732 . . . . 1.6100000000000001 112.976 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.3 -77.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.148 -0.316 . . . . 3.7000000000000002 110.148 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.415 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 104.11 31.65 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 O-C-N 125.864 1.977 . . . . 2.1000000000000001 110.352 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -88.71 142.66 27.49 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.98 108.982 177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.449 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 0.4 OUTLIER 65.83 56.22 0.9 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.042 0.448 . . . . 1.3799999999999999 110.023 -179.117 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 t -148.69 144.15 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.824 -0.625 . . . . 1.1100000000000001 111.022 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.19 143.15 26.71 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.842 0.354 . . . . 1.3200000000000001 110.734 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.07 -42.74 60.75 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.79 0.663 . . . . 1.1299999999999999 112.79 -179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.1 ttpp -59.47 -44.21 93.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.645 0.26 . . . . 1.75 111.083 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -35.31 78.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.06 -0.518 . . . . 0.98999999999999999 111.009 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -69.53 -48.24 61.13 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.99 -0.55 . . . . 3.3399999999999999 111.931 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -59.59 -40.58 87.87 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.096 0.475 . . . . 1.76 110.56 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.491 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 4.1 ttmt -57.82 -43.29 85.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.997 0.903 . . . . 1.45 110.115 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.71 HG13 HG12 ' A' ' 20' ' ' VAL . 3.3 t -64.38 -48.71 84.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.063 -1.426 . . . . 1.45 112.084 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 42' ' ' MET . 19.1 mt-10 -66.53 -43.74 84.38 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 112.915 0.709 . . . . 1.8700000000000001 112.915 -177.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.94 -33.82 76.94 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 120.971 0.415 . . . . 0.88 111.502 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.36 67.96 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.327 0.492 . . . . 0.70999999999999996 112.327 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 6.0 ptp -78.05 -27.67 48.76 Favored 'General case' 0 N--CA 1.441 -0.906 0 C-N-CA 120.816 -0.354 . . . . 1.47 111.502 -178.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.3 -39.67 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.424 -0.353 . . . . 0.93000000000000005 111.191 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.56 -43.85 95.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.743 0.306 . . . . 1.72 110.707 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.79 -10.12 59.68 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.202 -0.199 . . . . 0.98999999999999999 111.389 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 58.35 48.34 12.55 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.412 0.625 . . . . 2.2000000000000002 109.637 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -83.86 133.63 34.73 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.19 -0.914 . . . . 1.23 111.145 -178.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.2 tt -111.82 120.17 42.83 Favored Pre-proline 0 C--N 1.324 -0.534 0 N-CA-C 108.917 -0.771 . . . . 1.8799999999999999 108.917 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.57 121.79 10.64 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.722 2.281 . . . . 0.83999999999999997 113.119 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.581 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 56.5 t-20 -80.45 101.55 9.13 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.317 0.579 . . . . 1.1000000000000001 110.116 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.472 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 21.5 ttt180 -68.26 -22.92 64.73 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.691 -0.686 . . . . 4.7199999999999998 112.23 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.524 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -57.61 -45.14 85.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.058 0.456 . . . . 0.77000000000000002 110.552 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.67 -27.2 45.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.871 -0.604 . . . . 0.66000000000000003 111.112 179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 95.8 mt-30 -59.12 -41.39 88.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 116.175 -0.466 . . . . 1.46 110.922 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.602 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 3.5 mt-30 -86.86 -21.02 26.63 Favored 'General case' 0 N--CA 1.443 -0.825 0 N-CA-C 109.866 -0.42 . . . . 1.45 109.866 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.794 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 31.5 tp -62.67 -37.68 87.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.423 -0.808 . . . . 0.78000000000000003 111.575 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.34 10.49 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.836 1.05 . . . . 1.0800000000000001 113.836 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.1 47.56 0.51 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 119.907 -1.14 . . . . 1.6599999999999999 114.432 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.0 mttm -142.53 -88.52 0.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.209 0.505 . . . . 4.79 109.742 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.602 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 6.2 mp0 79.76 28.56 0.31 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.224 1.01 . . . . 2.3399999999999999 110.239 177.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -82.06 91.35 6.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.472 -0.785 . . . . 3.8599999999999999 110.361 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 26.6 tp . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.373 -0.822 . . . . 6.96 110.341 -179.149 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 110.169 -0.308 . . . . 6.9199999999999999 110.169 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' B' ' 2' ' ' LYS . 24.2 mmtp -88.45 -59.43 0.26 Allowed Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 109.721 -0.474 . . . . 6.4199999999999999 109.721 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' B' ' 2' ' ' LYS . 33.4 Cg_endo -67.6 88.37 0.34 Allowed 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 121.916 1.744 . . . . 2.1000000000000001 112.116 178.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 33.0 m -94.76 168.33 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.842 -0.617 . . . . 1.4299999999999999 110.766 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.561 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 81.0 p -84.17 168.36 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.718 -0.673 . . . . 0.81000000000000005 111.032 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.5 mt -74.45 -22.04 59.3 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 109.175 -0.676 . . . . 0.60999999999999999 109.175 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -66.98 -42.41 85.14 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 107.389 -1.337 . . . . 1.3200000000000001 107.389 177.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' B' ' 5' ' ' THR . 54.3 m-20 -57.57 -43.57 84.63 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 114.193 -1.367 . . . . 1.9399999999999999 110.059 178.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' B' ' 41' ' ' ALA . 68.7 t -68.8 -44.87 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 115.341 -0.845 . . . . 1.1399999999999999 110.696 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.3 -45.84 72.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.048 -0.524 . . . . 0.71999999999999997 111.144 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -62.3 -54.48 40.02 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.084 -0.507 . . . . 1.8899999999999999 112.295 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.412 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 21.2 t80 -55.4 -47.22 76.2 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.78 0.324 . . . . 1.46 111.259 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.69 -21.46 66.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.053 -0.521 . . . . 0.67000000000000004 112.36 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 72.98 50.09 14.32 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.313 -0.946 . . . . 1.21 111.81 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.8 m -143.99 -165.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.596 -0.52 . . . . 0.71999999999999997 109.596 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.469 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 93.1 p -101.48 160.06 14.76 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.926 0.393 . . . . 1.1000000000000001 110.594 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.482 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 63.5 t80 -63.69 -19.48 64.95 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.274 -0.421 . . . . 1.49 111.03 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.431 ' CB ' ' H73' ' D' ' 6' ' ' ' DT' . 8.3 tp60 -75.98 -41.86 50.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.322 -0.399 . . . . 1.4299999999999999 111.343 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.1 p -75.91 -25.81 56.4 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.773 -0.371 . . . . 0.78000000000000003 111.938 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -61.44 -43.94 97.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.005 -0.543 . . . . 1.0800000000000001 111.466 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 9.3 t -74.95 -29.22 60.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.972 0.415 . . . . 1.1200000000000001 109.982 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.558 ' HB3' HG22 ' B' ' 30' ' ' VAL . 54.5 mtt180 -58.02 -45.23 87.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.665 -0.698 . . . . 1.8799999999999999 110.573 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.459 HG13 ' HB2' ' B' ' 35' ' ' ARG . 65.8 t -56.91 -46.34 83.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.149 -0.478 . . . . 1.3899999999999999 110.661 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -65.0 -38.28 82.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.446 -0.797 . . . . 1.3100000000000001 110.22 179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -63.44 -25.07 68.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.806 -0.634 . . . . 2.1899999999999999 110.758 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 38.18 51.28 1.5 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 124.303 1.002 . . . . 3.2999999999999998 111.353 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -163.05 -26.01 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 114.251 -1.34 . . . . 3.0800000000000001 113.798 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -168.75 0.58 Allowed 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.23 0.538 . . . . 3.25 110.736 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -79.27 71.43 5.8 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.672 -1.233 . . . . 1.75 107.672 178.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.558 HG22 ' HB3' ' B' ' 22' ' ' ARG . 1.5 t -110.15 115.94 51.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.974 -0.557 . . . . 1.3500000000000001 111.857 -178.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -67.27 161.88 23.94 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.16 0.505 . . . . 1.5800000000000001 110.584 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.694 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -63.68 -50.83 67.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.807 -0.633 . . . . 1.27 110.53 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -58.13 -38.62 76.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.62 -0.718 . . . . 2.2000000000000002 111.612 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 11.0 m -59.7 -45.63 91.53 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.065 -0.516 . . . . 1.05 112.102 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.694 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 10.8 ptp180 -67.62 -36.5 80.92 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.638 -0.425 . . . . 1.54 111.104 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.04 -43.69 94.78 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.378 0.609 . . . . 1.97 110.006 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 46.2 tttt -60.68 -50.11 74.82 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.178 -0.919 . . . . 2.5 110.426 178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' B' ' 23' ' ' VAL . 45.1 t -65.39 -46.46 90.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 N-CA-C 113.948 1.092 . . . . 1.3799999999999999 113.948 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' B' ' 35' ' ' ARG . 0.3 OUTLIER -61.91 -21.22 64.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 121.034 -0.267 . . . . 2.0699999999999998 111.683 -177.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.06 -47.23 83.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.872 -0.418 . . . . 0.91000000000000003 109.872 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.554 ' HB3' HG13 ' B' ' 9' ' ' VAL . . . -67.43 -34.77 77.9 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.224 0.535 . . . . 0.72999999999999998 110.309 179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 21.2 mtt -56.22 -51.22 68.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.86 -1.064 . . . . 1.3999999999999999 110.967 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.17 -52.12 15.32 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 112.161 0.43 . . . . 1.03 112.161 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -55.23 -43.65 74.72 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.939 0.4 . . . . 2.1000000000000001 111.792 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.2 mt -93.69 -12.99 28.03 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.402 0.519 . . . . 0.83999999999999997 112.402 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t30 65.36 60.33 0.76 Allowed 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.35 0.5 . . . . 1.5600000000000001 112.35 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.471 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.0 t80 -63.45 127.44 31.31 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 120.847 0.356 . . . . 0.88 110.392 179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 26.2 mm -118.42 117.25 34.74 Favored Pre-proline 0 N--CA 1.445 -0.683 0 N-CA-C 109.081 -0.711 . . . . 1.6000000000000001 109.081 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -67.5 119.81 6.83 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.77 1.647 . . . . 1.45 112.092 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 37.5 m-80 -82.08 115.48 21.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.67 -0.695 . . . . 1.0900000000000001 109.283 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.449 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 10.4 tpp180 -62.56 -37.41 86.04 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.922 0.391 . . . . 3.3900000000000001 110.719 -178.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -66.22 -44.25 84.37 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 116.043 -0.526 . . . . 0.82999999999999996 111.441 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.45 45.61 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.521 -0.309 . . . . 0.63 111.171 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 59' ' ' LYS . 73.4 mt-30 -55.64 -39.5 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.395 0.435 . . . . 1.3300000000000001 111.143 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.526 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -73.17 -41.08 64.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 3.0299999999999998 111.251 179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.639 HD13 HD22 ' A' ' 56' ' ' LEU . 2.5 mt -68.67 -27.34 65.89 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.501 0.667 . . . . 1.21 110.33 -179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.01 1.03 4.98 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.322 -0.854 . . . . 0.98999999999999999 112.746 179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 116.36 17.37 6.19 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 119.715 -1.231 . . . . 2.0899999999999999 113.382 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 54' ' ' GLN . 29.5 mttp -114.26 105.18 12.86 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 109.018 -0.734 . . . . 5.9199999999999999 109.018 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -70.93 78.19 0.64 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.31 -0.859 . . . . 4.8300000000000001 109.972 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.2 m -98.36 -13.76 20.51 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.322 -0.854 . . . . 6.0899999999999999 111.491 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 18.4 mt . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.572 -0.727 . . . . 7.79 109.521 179.234 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.489 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.449 -2.322 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.489 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.501 -1.437 0 C3'-C2'-C1' 99.602 -2.213 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.438 H2'' ' H8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 C3'-C2'-C1' 99.622 -2.199 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.597 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.138 0 C3'-C2'-C1' 99.292 -2.434 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.597 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.888 0 C3'-C2'-C1' 98.856 -2.746 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.532 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.653 0 C3'-C2'-C1' 99.428 -2.337 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.556 -2.245 . . . . 0.92000000000000004 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.333 -2.405 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.106 0 C3'-C2'-C1' 99.469 -2.308 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.267 0 C3'-C2'-C1' 99.73 -2.121 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.566 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.938 0 C3'-C2'-C1' 100.003 -1.926 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.566 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.86 0 C3'-C2'-C1' 98.554 -2.962 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.022 0 C3'-C2'-C1' 99.472 -2.306 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.436 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.742 0 C3'-C2'-C1' 99.044 -2.611 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.436 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.704 0 C3'-C2'-C1' 99.546 -2.253 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.861 0 C3'-C2'-C1' 99.894 -2.004 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.418 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.821 0 C3'-C2'-C1' 99.457 -2.317 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.531 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.083 -2.584 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.531 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.25 -2.464 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.491 H2'' ' C5 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 O4'-C1'-C2' 103.891 -2.008 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.491 ' C5 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.868 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.474 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.513 -2.277 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 N19-C1'-C2' 115.831 1.019 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.709 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.785 0 C3'-C2'-C1' 100.617 -1.488 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.709 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 101.845 -0.611 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.634 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.731 0 C3'-C2'-C1' 101.337 -0.973 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.634 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 O4'-C1'-C2' 104.599 -1.364 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.439 -0.662 0 C3'-C2'-C1' 105.049 1.678 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.551 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.837 0 C3'-C2'-C1' 105.262 1.83 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.551 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.849 0 C3'-C2'-C1' 104.824 1.517 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.751 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 C3'-C2'-C1' 105.541 2.03 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.751 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 P--O3' 1.618 0.939 0 O4'-C1'-C2' 106.981 0.801 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.623 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C4'-C3'-O3' 113.502 1.455 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.623 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 P-O3'-C3' 120.892 0.993 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.794 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.406 -1.11 0 C1'-O4'-C4' 106.887 -2.01 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.503 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 C3'-C2'-C1' 104.966 1.619 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.281 1.081 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.484 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.615 0.655 0 C4'-C3'-C2' 104.245 1.045 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 C4'-C3'-C2' 101.835 -1.365 . . . . 1.5900000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.406 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 100.742 -1.398 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.489 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.515 0 C2'-C3'-O3' 112.514 0.709 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 N19-C1'-C2' 115.824 1.015 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 104.399 1.199 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.956 0 C3'-C2'-C1' 99.598 -2.216 . . . . 2.1400000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.851 0 O4'-C1'-C2' 105.254 -0.769 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.512 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.2 mmm . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 110.266 -0.272 . . . . 5.7999999999999998 110.266 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.8 tttp -102.8 100.92 17.95 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.254 -0.43 . . . . 5.3499999999999996 110.0 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HD3' ' O ' ' A' ' 1' ' ' MET . 1.2 Cg_endo -80.16 65.78 8.87 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.113 2.542 . . . . 2.4300000000000002 113.772 -178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -96.26 124.48 48.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.766 -0.457 . . . . 1.03 109.766 178.087 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 9' ' ' VAL . 49.8 p -103.09 179.29 4.31 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.112 0.482 . . . . 0.76000000000000001 111.727 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.603 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -70.14 -20.81 63.14 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.735 -0.666 . . . . 0.98999999999999999 109.723 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -70.02 -34.02 72.74 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 109.123 -0.695 . . . . 1.51 109.123 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -75.0 -48.72 22.71 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.714 -0.676 . . . . 1.6699999999999999 109.83 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 5' ' ' THR . 32.7 t -59.18 -36.68 64.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 114.756 -1.111 . . . . 0.70999999999999996 110.679 179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -65.85 -42.07 90.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 0.68000000000000005 111.164 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -65.56 -41.88 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.286 0.565 . . . . 2.3999999999999999 109.507 178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -66.26 -36.43 82.97 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.425 -0.807 . . . . 1.47 110.278 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.68 -18.97 58.23 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.245 -0.888 . . . . 0.77000000000000002 110.028 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.64 34.15 36.09 Favored Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.846 -0.616 . . . . 1.3700000000000001 113.405 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.3 m -142.97 -172.74 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 110.015 -0.365 . . . . 0.77000000000000002 110.015 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.424 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 5.5 m -75.1 -172.73 1.76 Allowed 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.876 -0.416 . . . . 1.3300000000000001 109.876 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.603 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 48.1 p90 -90.17 -0.01 57.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.715 -0.394 . . . . 1.3200000000000001 111.312 -178.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.436 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.0 tp-100 -90.3 -31.76 16.81 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.55 -0.46 . . . . 1.4399999999999999 111.058 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.91 -40.23 83.88 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.068 -0.515 . . . . 0.77000000000000002 111.968 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.416 HG12 ' HB ' ' A' ' 38' ' ' VAL . 28.1 m -76.94 -24.5 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 CA-C-O 120.889 0.376 . . . . 1.3799999999999999 110.748 -179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.1 t -81.95 -46.24 14.29 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.417 0.627 . . . . 1.0800000000000001 110.369 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.486 ' HG3' ' CB ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -58.56 -30.87 67.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.729 -0.668 . . . . 2.5499999999999998 111.708 -178.698 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.618 HG21 ' HA ' ' A' ' 35' ' ' ARG . 72.2 t -85.77 -32.18 6.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.459 -0.337 . . . . 1.6299999999999999 111.22 -178.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.2 t -68.48 -25.94 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.329 -0.619 . . . . 1.3799999999999999 109.329 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -94.83 -1.68 52.29 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.666 -0.697 . . . . 1.6100000000000001 109.929 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 59.03 43.05 18.17 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 114.176 -1.375 . . . . 3.7000000000000002 112.519 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.486 ' CB ' ' HG3' ' A' ' 22' ' ' ARG . . . -60.55 141.05 57.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.918 0.39 . . . . 2.1000000000000001 111.191 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.3 m -70.1 -39.19 75.68 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.732 -0.667 . . . . 1.98 112.15 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.584 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 4.4 m-70 -78.01 72.19 4.53 Favored 'General case' 0 C--O 1.223 -0.3 0 C-N-CA 121.146 -0.222 . . . . 1.3799999999999999 111.029 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -150.98 141.82 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 N-CA-C 112.795 0.665 . . . . 1.1100000000000001 112.795 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.6 m -71.69 172.24 10.08 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.825 -0.625 . . . . 1.3200000000000001 111.127 179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -84.04 -44.65 13.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.34 0.591 . . . . 1.1299999999999999 111.368 -178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -57.36 -48.29 79.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.022 -0.99 . . . . 1.75 113.149 -177.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.76 -29.76 63.58 Favored 'General case' 0 N--CA 1.441 -0.89 0 N-CA-C 111.854 0.316 . . . . 0.98999999999999999 111.854 -179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.618 ' HA ' HG21 ' A' ' 23' ' ' VAL . 33.9 ttp180 -64.8 -44.13 90.92 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.041 -0.527 . . . . 3.3399999999999999 109.601 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 66.1 mt-10 -72.37 -37.64 68.73 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.829 -0.623 . . . . 1.76 110.53 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -59.33 -49.92 75.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 1.45 111.934 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.416 ' HB ' HG12 ' A' ' 20' ' ' VAL . 33.2 m -66.88 -39.17 82.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 116.087 -0.506 . . . . 1.45 111.996 -178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -66.65 -43.03 85.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.736 0.303 . . . . 1.8700000000000001 110.859 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.25 -46.25 87.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.096 0.474 . . . . 0.88 111.397 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.85 -42.46 97.58 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.731 -0.668 . . . . 0.70999999999999996 112.307 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -69.77 -34.49 73.85 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.403 -0.362 . . . . 1.47 111.218 -178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.23 -34.51 55.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.087 0.47 . . . . 0.93000000000000005 110.345 179.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -57.95 -52.79 64.04 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.585 -0.734 . . . . 1.72 110.776 178.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 68.5 mt -83.36 0.41 46.09 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.172 -0.467 . . . . 0.98999999999999999 110.732 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 53.72 59.11 4.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.074 0.94 . . . . 2.2000000000000002 109.803 -178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.92 135.46 34.05 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.541 -1.209 . . . . 1.23 110.144 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.1 pt -118.35 113.91 36.74 Favored Pre-proline 0 N--CA 1.444 -0.754 0 N-CA-C 109.828 -0.434 . . . . 1.8799999999999999 109.828 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -58.44 128.4 28.28 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.151 1.901 . . . . 0.83999999999999997 111.334 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.443 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 44.2 t-20 -66.87 105.41 1.6 Allowed 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 109.075 -0.713 . . . . 1.1000000000000001 109.075 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 2.0 mpt_? -65.31 -22.96 66.89 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.78 -0.368 . . . . 4.7199999999999998 111.812 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.443 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 58.4 m -70.47 -57.61 4.6 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 107.954 -1.128 . . . . 0.77000000000000002 107.954 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.419 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -53.0 -35.72 59.67 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.748 -1.114 . . . . 0.66000000000000003 113.039 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.59 -27.72 63.32 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 120.136 -0.626 . . . . 1.46 111.334 -178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.604 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 35.1 mt-30 -83.02 -39.07 21.75 Favored 'General case' 0 N--CA 1.446 -0.667 0 N-CA-C 107.622 -1.251 . . . . 1.45 107.622 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.92 HD22 HD13 ' B' ' 56' ' ' LEU . 9.4 tp -54.76 -38.53 67.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.351 -1.295 . . . . 0.78000000000000003 112.412 178.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.418 ' HB2' ' O2 ' ' D' ' 13' ' ' ' DC' . . . -65.3 -4.62 5.62 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.241 0.83 . . . . 1.0800000000000001 113.241 -178.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 125.3 31.35 0.85 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.504 -1.331 . . . . 1.6599999999999999 113.22 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -130.82 4.72 4.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.432 0.634 . . . . 4.79 109.783 179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.567 ' NE2' " H5'" ' C' ' 11' ' ' ' DG' . 1.0 OUTLIER -69.86 -39.35 76.42 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.147 -0.933 . . . . 2.3399999999999999 109.885 179.87 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.91 138.52 37.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.509 -0.769 . . . . 3.8599999999999999 110.187 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.547 HD21 ' SD ' ' B' ' 1' ' ' MET . 1.6 pt? . . . . . 0 C--O 1.248 1.0 0 CA-C-N 115.931 -0.577 . . . . 6.96 109.623 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.547 ' SD ' HD21 ' A' ' 62' ' ' LEU . 21.2 mmt . . . . . 0 N--CA 1.487 1.399 0 N-CA-C 110.045 -0.354 . . . . 6.9199999999999999 110.045 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -134.71 120.4 14.38 Favored Pre-proline 0 C--N 1.323 -0.564 0 C-N-CA 120.96 -0.296 . . . . 6.4199999999999999 111.727 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -83.41 -168.16 0.54 Allowed 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 123.641 2.894 . . . . 2.1000000000000001 112.236 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.429 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 2.5 p -73.07 130.87 35.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.439 -0.8 . . . . 1.4299999999999999 109.094 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.627 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 82.4 p -82.17 171.27 14.5 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 121.284 0.564 . . . . 0.81000000000000005 111.585 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.455 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.7 mt -78.98 -17.15 55.91 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.116 -1.438 . . . . 0.60999999999999999 107.116 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -75.78 -12.19 60.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 113.299 -1.773 . . . . 1.3200000000000001 110.579 178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -94.63 -52.69 4.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 106.011 -1.848 . . . . 1.9399999999999999 106.011 -177.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.651 HG21 ' HB2' ' B' ' 47' ' ' TYR . 38.5 t -60.2 -40.77 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 111.944 -2.389 . . . . 1.1399999999999999 113.937 -178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.36 -37.01 64.47 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 111.962 0.356 . . . . 0.71999999999999997 111.962 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.22 -32.79 73.26 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 121.009 0.433 . . . . 1.8899999999999999 110.128 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -69.26 -51.59 36.03 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.772 -0.649 . . . . 1.46 109.686 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.75 64.47 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 113.252 0.834 . . . . 0.67000000000000004 113.252 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 71.04 50.14 24.43 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.14 -1.029 . . . . 1.21 111.614 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.725 HG21 HG22 ' B' ' 38' ' ' VAL . 6.8 m -143.43 158.89 17.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.304 -0.628 . . . . 0.71999999999999997 109.304 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 1.3 m -66.54 149.37 50.56 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.746 -0.465 . . . . 1.1000000000000001 109.746 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.469 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 52.9 t80 -55.09 -38.92 68.73 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.464 0.306 . . . . 1.49 111.804 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.426 ' HG3' ' H62' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -69.09 -35.81 76.9 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.691 -0.403 . . . . 1.4299999999999999 110.649 178.631 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 1.8 m -67.53 -39.6 85.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 121.164 0.506 . . . . 0.78000000000000003 110.771 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.85 -35.97 58.83 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 115.783 -0.644 . . . . 1.0800000000000001 110.843 178.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.453 ' O ' HG12 ' B' ' 24' ' ' VAL . 18.1 t -68.25 -36.95 80.23 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.178 0.513 . . . . 1.1200000000000001 110.251 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.424 ' HB3' ' CG2' ' B' ' 30' ' ' VAL . 99.1 mtt180 -55.8 -46.03 78.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 1.8799999999999999 110.66 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.63 HG22 HG11 ' B' ' 30' ' ' VAL . 40.3 t -74.62 -38.5 45.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.974 0.416 . . . . 1.3899999999999999 110.976 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.453 HG12 ' O ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -59.57 -25.56 31.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 115.356 -0.838 . . . . 1.3100000000000001 112.635 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -91.08 -32.59 15.82 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.845 -0.342 . . . . 2.1899999999999999 110.821 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 156.75 -57.25 0.0 OUTLIER 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.418 1.087 . . . . 3.2999999999999998 109.453 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 172.07 172.31 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.307 1.043 . . . . 3.0800000000000001 108.455 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.614 ' H ' HG23 ' B' ' 30' ' ' VAL . 3.1 m 155.48 88.3 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.219 1.408 . . . . 3.25 107.967 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 46.6 m80 63.38 46.2 4.52 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 109.621 -0.511 . . . . 1.75 109.621 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.63 HG11 HG22 ' B' ' 23' ' ' VAL . 2.0 t -122.36 118.66 56.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.949 -0.569 . . . . 1.3500000000000001 111.761 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.451 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 32.4 t -67.34 154.49 41.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.226 0.536 . . . . 1.5800000000000001 110.513 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.563 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -56.22 -54.71 42.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.32 -0.855 . . . . 1.27 112.274 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 30.5 mmtp -65.97 -22.97 66.5 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.485 -0.325 . . . . 2.2000000000000002 111.022 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.451 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 96.3 m -70.39 -49.07 52.84 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.171 0.51 . . . . 1.05 110.182 179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 6.7 ptp180 -69.64 -29.95 67.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.743 -0.662 . . . . 1.54 111.095 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -55.62 -49.68 72.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.884 0.374 . . . . 1.97 110.144 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -55.55 -51.94 65.37 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.284 -0.871 . . . . 2.5 110.164 178.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.725 HG22 HG21 ' B' ' 15' ' ' VAL . 21.8 t -58.8 -37.94 69.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 113.24 0.83 . . . . 1.3799999999999999 113.24 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -62.3 -36.76 83.13 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 122.022 -0.424 . . . . 2.0699999999999998 111.235 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -58.74 7.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.888 -0.596 . . . . 0.91000000000000003 110.354 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.406 ' HB1' HG13 ' B' ' 9' ' ' VAL . . . -58.94 -37.5 76.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.141 -0.481 . . . . 0.72999999999999998 111.315 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.5 ttm -57.41 -53.76 54.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.013 -0.54 . . . . 1.3999999999999999 111.888 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.41 -42.78 29.13 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.351 0.5 . . . . 1.03 112.351 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -61.76 -42.31 98.81 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 116.276 -0.42 . . . . 2.1000000000000001 111.881 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 38.4 mt -94.09 -7.08 43.54 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.249 -0.58 . . . . 0.83999999999999997 111.413 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 t30 56.52 65.64 1.37 Allowed 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.904 0.383 . . . . 1.5600000000000001 111.742 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.651 ' HB2' HG21 ' B' ' 9' ' ' VAL . 18.5 t80 -70.78 127.98 34.48 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 109.359 -0.608 . . . . 0.88 109.359 179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 47.6 mt -113.09 108.59 52.92 Favored Pre-proline 0 C--N 1.317 -0.817 0 N-CA-C 108.767 -0.827 . . . . 1.6000000000000001 108.767 179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.408 ' HA ' ' CZ ' ' B' ' 47' ' ' TYR . 7.6 Cg_endo -54.2 126.29 21.64 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.808 2.339 . . . . 1.45 112.725 -178.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -86.51 98.44 11.05 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.26 -1.015 . . . . 1.0900000000000001 108.26 178.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 51' ' ' ARG . 0.2 OUTLIER -53.52 -39.96 65.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.729 -0.669 . . . . 3.3900000000000001 110.344 -179.191 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.503 ' O ' HD12 ' B' ' 56' ' ' LEU . 6.2 m -57.38 -43.92 84.03 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.622 -0.717 . . . . 0.82999999999999996 111.254 179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.13 -44.97 24.58 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 121.436 -0.106 . . . . 0.63 111.167 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -54.06 -51.09 65.19 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.825 0.345 . . . . 1.3300000000000001 111.549 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.47 ' OE1' ' HE3' ' B' ' 59' ' ' LYS . 10.3 mm100 -63.86 -36.45 83.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.043 -0.526 . . . . 3.0299999999999998 111.483 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.92 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -62.55 -33.22 74.49 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.171 -0.922 . . . . 1.21 112.757 -179.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.12 -45.86 83.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 119.894 -0.722 . . . . 0.98999999999999999 110.77 -177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 174.92 40.05 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 117.64 -2.219 . . . . 2.0899999999999999 112.236 174.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.47 ' HE3' ' OE1' ' B' ' 55' ' ' GLN . 0.3 OUTLIER -119.54 97.28 5.57 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.247 0.546 . . . . 5.9199999999999999 109.813 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 22.5 mp0 -90.8 100.33 13.21 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.46 -0.791 . . . . 4.8300000000000001 110.005 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.35 74.46 8.35 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 112.055 0.391 . . . . 6.0899999999999999 112.055 -178.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 29.2 tp . . . . . 0 C--O 1.244 0.798 0 CA-C-N 115.084 -0.962 . . . . 7.79 111.163 179.162 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.433 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.193 0 C3'-C2'-C1' 98.728 -2.837 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.508 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 99.671 -2.164 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.599 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.44 0.673 0 C3'-C2'-C1' 99.909 -1.994 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.599 ' C8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 P--O3' 1.621 1.152 0 C3'-C2'-C1' 99.953 -1.962 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.501 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.142 -2.541 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.51 H2'' ' C6 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.914 -1.99 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.51 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.016 -2.631 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.332 -2.406 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.105 -2.568 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.411 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.456 0 C3'-C2'-C1' 99.478 -2.302 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.489 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.368 0 C3'-C2'-C1' 100.116 -1.846 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.742 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.043 0 C3'-C2'-C1' 99.785 -2.082 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.61 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.286 0 C3'-C2'-C1' 98.729 -2.837 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.524 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.767 0 C3'-C2'-C1' 99.907 -1.995 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.524 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 C3'-C2'-C1' 99.647 -2.181 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.426 ' H62' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.511 -0.706 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.719 0 O4'-C1'-C2' 103.88 -2.019 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 C3'-C2'-C1' 99.528 -2.265 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.483 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.099 0 C3'-C2'-C1' 99.052 -2.606 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.624 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.452 0.555 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.624 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.798 0 O4'-C1'-C2' 103.964 -1.942 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.583 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.46 -2.314 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.408 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -1.016 0 C3'-C2'-C1' 99.509 -2.279 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.863 0 O4'-C1'-C2' 105.142 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.519 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 100.623 -1.484 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.519 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C5'-C4'-C3' 116.161 0.974 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.711 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-C2' 104.911 -1.081 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.711 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-C2' 104.579 1.379 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.698 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 O4'-C1'-C2' 107.246 1.042 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.698 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 P--O3' 1.62 1.107 0 C3'-C2'-C1' 105.583 2.06 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.604 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.524 0.622 0 C4'-C3'-C2' 104.896 1.696 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C4'-C3'-C2' 104.669 1.469 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.584 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 O4'-C1'-C2' 105.18 -0.837 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.584 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 O4'-C1'-C2' 107.481 1.255 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.781 0 C3'-C2'-C1' 105.356 1.897 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.826 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.406 -1.039 0 C4'-C3'-C2' 104.538 1.338 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.421 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.894 0 C3'-C2'-C1' 105.242 1.815 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.605 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.884 0 O4'-C1'-C2' 104.716 -1.258 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.605 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.792 0 C3'-C2'-C1' 101.475 -0.875 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.456 ' C8 ' ' C2 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 101.386 -0.938 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.932 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 105.106 1.719 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.932 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.619 1.0 0 P-O3'-C3' 120.67 0.808 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.556 H2'' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.928 0 C3'-C2'-C1' 100.187 -1.795 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.556 ' C6 ' H2'' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.683 1.483 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 N19-C1'-C2' 116.136 1.21 . . . . 2.1400000000000001 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 C3'-C2'-C1' 100.164 -1.811 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.3 tpt . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 110.408 -0.219 . . . . 5.7999999999999998 110.408 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -81.69 131.4 57.81 Favored Pre-proline 0 CA--C 1.514 -0.418 0 N-CA-C 109.356 -0.609 . . . . 5.3499999999999996 109.356 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -72.91 119.16 5.9 Favored 'Trans proline' 0 N--CA 1.446 -1.266 0 C-N-CA 121.378 1.385 . . . . 2.4300000000000002 110.461 179.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -85.18 156.26 3.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 47.3 p -138.6 173.42 11.61 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.037 -0.727 . . . . 0.76000000000000001 109.037 -179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.458 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.5 pt? -67.17 -16.98 64.64 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.795 -0.362 . . . . 0.98999999999999999 111.491 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -73.45 -36.93 65.97 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.595 -0.52 . . . . 1.51 109.595 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.59 -56.59 18.23 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.4 0.619 . . . . 1.6699999999999999 109.362 179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.3 t -54.82 -43.74 68.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.21 -1.359 . . . . 0.70999999999999996 111.114 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.78 -48.23 75.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.387 -0.369 . . . . 0.68000000000000005 111.598 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.07 89.39 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 2.3999999999999999 110.919 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -67.06 -32.65 73.98 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.205 -0.452 . . . . 1.47 111.845 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.72 -24.02 29.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.158 -0.473 . . . . 0.77000000000000002 111.889 -179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.19 38.21 11.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.253 -0.975 . . . . 1.3700000000000001 112.503 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 m -146.25 -176.8 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 N-CA-C 109.075 -0.713 . . . . 0.77000000000000002 109.075 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.5 p -74.71 -165.6 0.37 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.886 -0.412 . . . . 1.3300000000000001 109.886 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 28.7 p90 -100.25 -9.97 21.82 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.678 -0.49 . . . . 1.3200000000000001 109.678 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -77.09 -34.29 56.94 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.461 0.648 . . . . 1.4399999999999999 109.487 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.17 -37.86 86.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.741 -1.118 . . . . 0.77000000000000002 109.937 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' VAL . 78.1 t -78.21 -23.64 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 115.787 -0.642 . . . . 1.3799999999999999 110.561 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.408 ' O ' HG23 ' A' ' 24' ' ' VAL . 38.9 t -80.87 -24.5 38.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.033 -0.53 . . . . 1.0800000000000001 110.717 -178.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -75.58 -23.17 56.47 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.556 0.576 . . . . 2.5499999999999998 112.556 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.0 m -86.46 -28.33 5.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 O-C-N 121.388 -0.82 . . . . 1.6299999999999999 112.38 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -74.43 -23.31 18.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.047 0.451 . . . . 1.3799999999999999 109.979 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -102.48 7.31 40.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.595 -0.729 . . . . 1.6100000000000001 109.827 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 48.55 45.68 21.09 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.443 -1.253 . . . . 3.7000000000000002 111.623 -179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.83 157.61 24.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.513 -0.767 . . . . 2.1000000000000001 111.96 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.1 m -116.82 64.14 0.72 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.61 -0.723 . . . . 1.98 110.269 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.52 49.55 1.41 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.596 -0.729 . . . . 1.3799999999999999 109.289 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.3 170.98 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 114.667 -1.151 . . . . 1.1100000000000001 108.687 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -101.57 161.46 13.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 108.83 -0.804 . . . . 1.3200000000000001 108.83 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.77 -46.27 67.47 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 111.82 0.304 . . . . 1.1299999999999999 111.82 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -59.77 -48.98 79.52 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 1.75 112.003 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -67.83 -41.5 82.93 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 115.964 -0.562 . . . . 0.98999999999999999 111.271 -178.085 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.477 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 40.7 ttt180 -60.44 -50.3 74.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.53 -0.304 . . . . 3.3399999999999999 110.899 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -62.64 -42.29 99.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.298 -0.561 . . . . 1.76 111.443 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.9 -47.84 81.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.272 -0.422 . . . . 1.45 111.169 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.441 HG22 ' O ' ' A' ' 34' ' ' THR . 30.3 m -68.75 -38.68 79.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.268 -0.424 . . . . 1.45 111.574 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.6 mt-10 -67.6 -43.64 79.99 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.851 0.358 . . . . 1.8700000000000001 111.016 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.68 -43.76 79.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.79 0.329 . . . . 0.88 111.77 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -34.26 77.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.70999999999999996 111.528 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.4 ptm -74.12 -28.41 61.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.435 -0.348 . . . . 1.47 110.989 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.32 -40.04 37.85 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.942 -0.392 . . . . 0.93000000000000005 109.942 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -51.93 67.88 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.075 -0.511 . . . . 1.72 110.77 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.99 -12.23 60.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.829 -0.623 . . . . 0.98999999999999999 111.5 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 62.49 54.85 2.38 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 109.625 -0.509 . . . . 2.2000000000000002 109.625 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -86.06 138.11 32.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.003 -0.544 . . . . 1.23 110.667 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.7 tt -127.08 125.14 24.08 Favored Pre-proline 0 C--N 1.319 -0.747 0 N-CA-C 108.783 -0.821 . . . . 1.8799999999999999 108.783 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.429 ' HB2' ' NE2' ' A' ' 54' ' ' GLN . 32.6 Cg_endo -61.87 127.71 22.22 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.525 2.15 . . . . 0.83999999999999997 112.742 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 26.3 m-20 -77.82 97.41 5.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.529 . . . . 1.1000000000000001 111.136 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.471 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 9.6 tpt180 -63.23 -21.14 66.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.717 -0.674 . . . . 4.7199999999999998 112.403 -178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.13 -46.86 82.29 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.736 -0.602 . . . . 0.77000000000000002 109.53 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.618 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -74.06 -23.23 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.537 -0.756 . . . . 0.66000000000000003 110.594 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 79.8 mt-30 -64.23 -37.37 87.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.417 -0.81 . . . . 1.46 111.865 -179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.508 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 15.3 mt-30 -88.68 -19.57 25.98 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.678 -0.86 . . . . 1.45 108.678 -178.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.588 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 56.2 tp -67.43 -47.95 68.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.78 -1.1 . . . . 0.78000000000000003 111.117 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.41 1.8 15.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.711 -0.677 . . . . 1.0800000000000001 111.637 -179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.51 -107.08 0.79 Allowed Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 111.262 -0.735 . . . . 1.6599999999999999 111.262 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -125.21 133.15 52.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.153 -0.684 . . . . 4.79 109.153 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.508 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 11.6 mp0 -84.6 -28.08 26.78 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.895 -0.593 . . . . 2.3399999999999999 111.012 -179.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.584 ' OG ' ' HG3' ' B' ' 2' ' ' LYS . 1.7 m -107.57 73.6 0.92 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.712 -0.676 . . . . 3.8599999999999999 110.556 -179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.413 HD23 ' H ' ' A' ' 62' ' ' LEU . 1.5 pt? . . . . . 0 C--O 1.245 0.826 0 CA-C-O 118.378 -0.82 . . . . 6.96 110.393 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.8 mmt . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 109.938 -0.393 . . . . 6.9199999999999999 109.938 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.584 ' HG3' ' OG ' ' A' ' 61' ' ' SER . 44.6 tttm -86.4 125.32 68.02 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.996 -0.282 . . . . 6.4199999999999999 111.516 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -96.0 -176.97 0.37 Allowed 'Trans proline' 0 N--CA 1.445 -1.337 0 C-N-CA 122.997 2.465 . . . . 2.1000000000000001 111.696 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.9 m -124.24 -143.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.12 -1.067 . . . . 1.4299999999999999 108.12 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.507 ' O ' HG23 ' B' ' 9' ' ' VAL . 17.4 p -142.81 167.99 20.78 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.99 -1.115 . . . . 0.81000000000000005 107.99 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 6' ' ' LEU . 13.7 mt -76.61 -13.91 60.03 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.827 -1.175 . . . . 0.60999999999999999 107.827 178.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -76.4 -47.1 24.38 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.297 -0.865 . . . . 1.3200000000000001 109.438 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.54 -49.77 71.78 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.504 -0.771 . . . . 1.9399999999999999 110.663 178.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.599 ' HA ' HD12 ' B' ' 45' ' ' LEU . 6.0 t -64.16 -39.21 84.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.334 -0.848 . . . . 1.1399999999999999 110.688 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.08 62.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.579 -0.737 . . . . 0.71999999999999997 112.469 -178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -59.29 -37.15 76.99 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.707 0.262 . . . . 1.8899999999999999 111.707 -178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -61.54 -49.64 75.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 122.228 1.013 . . . . 1.46 109.971 179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.514 ' O ' ' HD2' ' B' ' 37' ' ' LYS . . . -73.0 -20.75 60.96 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 113.422 -1.717 . . . . 0.67000000000000004 112.894 -178.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.86 45.19 28.25 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.988 -1.101 . . . . 1.21 112.174 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.1 179.36 2.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.818 -0.438 . . . . 0.71999999999999997 109.818 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 51.1 m -93.69 146.33 23.92 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.145 0.498 . . . . 1.1000000000000001 111.415 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -45.07 -42.89 9.07 Favored 'General case' 0 CA--C 1.533 0.288 0 CA-C-N 114.954 -1.021 . . . . 1.49 112.082 179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.493 ' O ' ' HG3' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -63.26 -43.1 98.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.201 -0.454 . . . . 1.4299999999999999 110.711 -179.021 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -40.58 96.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.256 -0.429 . . . . 0.78000000000000003 110.51 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 50.6 t -60.19 -44.44 95.37 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.137 -0.483 . . . . 1.0800000000000001 109.884 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 48.4 t -62.65 -36.72 83.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.936 -0.575 . . . . 1.1200000000000001 110.408 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 56.0 mtt180 -59.28 -38.1 79.29 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 116.245 -0.434 . . . . 1.8799999999999999 111.088 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.511 HG22 HG11 ' B' ' 30' ' ' VAL . 45.0 t -70.03 -39.88 77.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.511 0.672 . . . . 1.3899999999999999 109.873 177.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 4.5 t -65.52 -53.62 37.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 114.844 -1.071 . . . . 1.3100000000000001 111.55 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 27' ' ' ALA . 1.3 p30 -87.43 5.7 37.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.247 -0.433 . . . . 2.1899999999999999 110.777 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 43.84 56.21 4.75 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.195 -0.911 . . . . 3.2999999999999998 111.016 -178.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.415 ' HB2' HD21 ' B' ' 25' ' ' ASN . . . -78.17 -11.81 59.95 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.807 -1.088 . . . . 3.0800000000000001 112.509 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 76.75 -173.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 O-C-N 124.124 0.89 . . . . 3.25 110.063 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 64.18 27.81 13.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.566 0.698 . . . . 1.75 110.018 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.511 HG11 HG22 ' B' ' 23' ' ' VAL . 2.8 t -116.62 116.06 51.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.981 -1.009 . . . . 1.3500000000000001 108.967 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.424 ' O ' ' HB ' ' B' ' 34' ' ' THR . 5.3 t -59.72 150.29 28.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.98 0.419 . . . . 1.5800000000000001 110.625 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -49.64 75.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.222 -0.445 . . . . 1.27 110.761 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtp -62.96 -17.21 61.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.436 0.636 . . . . 2.2000000000000002 111.354 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.424 ' HB ' ' O ' ' B' ' 31' ' ' SER . 53.3 m -85.34 -51.93 6.23 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.012 -0.54 . . . . 1.05 111.017 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -67.46 -30.27 69.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.342 -0.39 . . . . 1.54 110.696 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.96 -48.47 78.28 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.099 -0.501 . . . . 1.97 109.997 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.514 ' HD2' ' O ' ' B' ' 13' ' ' ALA . 33.2 mtmm -58.7 -52.82 64.07 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 115.917 -0.583 . . . . 2.5 109.821 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 45.4 t -50.76 -43.69 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 116.034 -0.53 . . . . 1.3799999999999999 111.731 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -62.11 -42.21 99.0 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.751 0.31 . . . . 2.0699999999999998 110.739 -179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.36 -45.26 95.13 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.011 -0.541 . . . . 0.91000000000000003 110.242 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.83 -44.62 73.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.124 -0.489 . . . . 0.72999999999999998 111.304 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 0.0 OUTLIER -56.27 -40.17 73.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.541 0.21 . . . . 1.3999999999999999 111.109 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . 0.404 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -77.52 -40.03 44.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.768 0.318 . . . . 1.03 111.588 178.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 51.1 tp10 -73.77 -24.8 59.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.464 0.542 . . . . 2.1000000000000001 112.464 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' B' ' 9' ' ' VAL . 56.3 mt -105.12 -18.76 14.04 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.857 -0.527 . . . . 0.83999999999999997 112.237 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 51.1 t30 68.73 70.45 0.29 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.246 0.546 . . . . 1.5600000000000001 111.884 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.636 ' HA ' HG22 ' B' ' 4' ' ' VAL . 78.1 t80 -80.75 119.76 23.75 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 119.904 -0.718 . . . . 0.88 110.767 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 10.8 mt -115.91 115.14 41.3 Favored Pre-proline 0 C--N 1.318 -0.772 0 N-CA-C 107.605 -1.257 . . . . 1.6000000000000001 107.605 177.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -52.11 116.88 3.08 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.722 2.282 . . . . 1.45 112.482 -178.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.439 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 61.0 t-20 -71.01 96.03 1.26 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.652 -0.704 . . . . 1.0900000000000001 109.849 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 51' ' ' ARG . 60.6 mmt-85 -53.19 -42.54 66.34 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 112.528 0.566 . . . . 3.3900000000000001 112.528 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 18.6 m -58.14 -43.36 87.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 120.573 0.225 . . . . 0.82999999999999996 110.605 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.84 -45.54 57.82 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 116.523 -0.308 . . . . 0.63 111.007 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -53.53 -45.61 69.86 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.345 0.498 . . . . 1.3300000000000001 112.345 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.83 -24.61 55.86 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 120.987 0.422 . . . . 3.0299999999999998 111.46 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.618 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.7 mt -81.06 -27.15 35.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.976 -0.557 . . . . 1.21 109.774 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.73 9.4 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.373 -0.831 . . . . 0.98999999999999999 112.776 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 89.0 38.42 6.85 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 121.133 -0.556 . . . . 2.0899999999999999 112.964 178.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -100.4 3.77 43.38 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.516 -0.474 . . . . 5.9199999999999999 109.748 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -103.78 101.42 11.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.437 -0.347 . . . . 4.8300000000000001 110.828 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.01 74.93 8.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.719 0.295 . . . . 6.0899999999999999 110.574 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' B' ' 62' ' ' LEU . 10.8 tp . . . . . 0 C--O 1.246 0.907 0 CA-C-N 115.768 -0.651 . . . . 7.79 111.103 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.484 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.479 -2.3 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.261 0 C3'-C2'-C1' 99.683 -2.155 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 99.813 -2.062 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.447 ' H8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.962 0 C3'-C2'-C1' 99.386 -2.367 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.441 ' C7 ' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.931 0 C3'-C2'-C1' 99.061 -2.599 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.434 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.876 -2.017 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.451 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.985 0 C3'-C2'-C1' 99.788 -2.08 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.451 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C3'-C2'-C1' 99.498 -2.287 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 99.536 -2.26 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.181 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 104.127 -1.794 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.451 ' C6 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.87 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.484 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.713 -2.134 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.482 H2'' ' C6 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.666 0 C3'-C2'-C1' 99.815 -2.061 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.482 ' C6 ' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.205 -2.497 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.779 0 C3'-C2'-C1' 99.423 -2.341 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.921 0 C3'-C2'-C1' 99.561 -2.242 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.549 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 C3'-C2'-C1' 99.705 -2.139 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.549 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.976 0 C3'-C2'-C1' 99.272 -2.448 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.604 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.776 0 C3'-C2'-C1' 99.559 -2.244 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.604 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.721 -2.128 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.525 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.34 -2.4 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.525 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 C3'-C2'-C1' 99.589 -2.222 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 C3'-C2'-C1' 101.309 -0.993 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.423 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.651 -1.464 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.423 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 104.532 1.309 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.553 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.843 0 C4'-C3'-C2' 104.915 1.715 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.595 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -0.995 0 C4'-C3'-C2' 104.511 1.311 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.595 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.141 0 O4'-C1'-C2' 105.395 -0.641 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.463 ' H72' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 N19-C1'-C2' 115.724 0.952 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.402 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.752 0 O4'-C1'-C2' 104.587 -1.375 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.603 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.439 1.956 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.603 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 101.411 -0.921 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.435 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 105.705 2.147 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.435 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 C4'-C3'-C2' 104.251 1.051 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.588 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.122 0 C3'-C2'-C1' 105.31 1.865 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.464 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.842 0 C3'-C2'-C1' 105.224 1.803 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C3'-C2'-C1' 100.229 -1.765 . . . . 0.77000000000000002 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.673 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.524 0.64 0 C3'-C2'-C1' 105.75 2.179 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.673 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.624 1.442 0 P-O3'-C3' 120.581 0.734 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.679 " H1'" ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C3'-C2'-C1' 100.118 -1.844 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.679 ' C8 ' " H1'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 C5'-C4'-C3' 115.601 0.6 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 N19-C1'-C2' 116.12 1.2 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.415 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 N19-C1'-C2' 116.065 1.166 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.415 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.829 -1.337 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.251 1.051 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 mmt . . . . . 0 N--CA 1.471 0.624 0 N-CA-C 109.938 -0.393 . . . . 5.7999999999999998 109.938 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.4 ttpp -77.22 122.57 86.4 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 116.412 -0.358 . . . . 5.3499999999999996 110.608 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -59.91 130.14 33.52 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 122.225 1.95 . . . . 2.4300000000000002 109.699 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.507 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 9.0 t -67.0 128.87 30.95 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.555 0 N-CA-C 108.805 -0.813 . . . . 1.03 108.805 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.7 p -91.09 173.05 8.15 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.43 -0.581 . . . . 0.76000000000000001 109.43 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.495 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.4 OUTLIER -71.56 -18.82 62.22 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 120.418 -0.513 . . . . 0.98999999999999999 110.198 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -80.56 -10.4 59.74 Favored 'General case' 0 N--CA 1.446 -0.666 0 O-C-N 122.133 -0.354 . . . . 1.51 110.707 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -93.27 -55.68 3.22 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 103.748 -2.686 . . . . 1.6699999999999999 103.748 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 44.7 t -48.28 -48.07 13.57 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.234 0 CA-C-N 111.005 -2.816 . . . . 0.70999999999999996 111.354 177.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.75 -54.35 35.08 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 112.715 0.635 . . . . 0.68000000000000005 112.715 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -66.65 -39.13 88.09 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 119.891 -0.724 . . . . 2.3999999999999999 110.642 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.89 -27.19 68.63 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.515 0.674 . . . . 1.47 109.454 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -91.08 -20.27 22.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.943 -1.026 . . . . 0.77000000000000002 110.598 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 109.34 -55.17 0.52 Allowed Glycine 0 N--CA 1.435 -1.387 0 N-CA-C 110.962 -0.855 . . . . 1.3700000000000001 110.962 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.412 HG21 ' HB ' ' A' ' 19' ' ' THR . 19.7 m -57.34 176.22 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 116.011 1.856 . . . . 0.77000000000000002 116.011 -179.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 m -88.32 141.97 28.12 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 112.181 -2.281 . . . . 1.3300000000000001 110.864 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.45 ' HB2' HD12 ' A' ' 6' ' ' LEU . 13.0 p90 -36.97 -18.86 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.502 -1.681 . . . . 1.3200000000000001 114.733 178.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.567 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.4 tp-100 -80.93 -43.45 19.75 Favored 'General case' 0 C--N 1.329 -0.32 0 O-C-N 121.319 -0.863 . . . . 1.4399999999999999 111.457 178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG21 ' A' ' 15' ' ' VAL . 0.2 OUTLIER -55.37 -39.43 70.1 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.42 -0.809 . . . . 0.77000000000000002 111.542 -178.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' HG22 ' A' ' 23' ' ' VAL . 3.9 p -73.35 -43.72 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 116.573 -0.285 . . . . 1.3799999999999999 111.762 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.495 ' HB2' HD22 ' A' ' 6' ' ' LEU . 16.4 t -72.92 -25.07 60.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.201 0.524 . . . . 1.0800000000000001 111.809 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -63.16 -23.42 67.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 2.5499999999999998 111.938 -178.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.723 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 13.1 m -82.76 -19.12 10.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.264 -0.575 . . . . 1.6299999999999999 110.485 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.31 -62.9 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.843 -0.617 . . . . 1.3799999999999999 111.854 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -65.69 -57.75 7.33 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.057 0.762 . . . . 1.6100000000000001 113.057 -178.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -120.17 -78.12 0.59 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.864 -0.421 . . . . 3.7000000000000002 109.864 179.565 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.723 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 101.63 12.34 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 O-C-N 125.521 1.763 . . . . 2.1000000000000001 109.582 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.4 m -81.67 147.17 29.66 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.067 -0.969 . . . . 1.98 109.63 178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.401 ' O ' ' C7 ' ' C' ' 4' ' ' ' DT' . 1.9 m80 66.59 48.71 1.42 Allowed 'General case' 0 C--O 1.222 -0.356 0 O-C-N 123.498 0.499 . . . . 1.3799999999999999 110.789 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.81 132.48 53.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.555 -0.906 . . . . 1.1100000000000001 108.555 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.465 ' H ' " H3'" ' C' ' 3' ' ' ' DA' . 90.5 p -61.03 146.18 48.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.068 0.937 . . . . 1.3200000000000001 112.597 -178.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.35 -8.76 14.26 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.117 -1.401 . . . . 1.1299999999999999 112.374 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -93.7 -57.0 2.7 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 106.593 -1.632 . . . . 1.75 106.593 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.1 m -59.19 -31.93 69.46 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 113.113 -1.858 . . . . 0.98999999999999999 111.885 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.458 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 55.3 ttp180 -51.53 -62.21 1.77 Allowed 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.065 0.459 . . . . 3.3399999999999999 110.235 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -62.25 -36.55 82.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.69 -0.686 . . . . 1.76 112.22 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt -58.13 -45.99 86.37 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.598 0.713 . . . . 1.45 110.238 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.88 -43.41 98.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 114.442 -1.254 . . . . 1.45 110.704 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 43.0 mt-10 -68.82 -38.54 79.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.936 -0.574 . . . . 1.8700000000000001 111.482 -178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.36 -44.05 88.89 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.986 -0.552 . . . . 0.88 111.881 -179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.8 -36.74 73.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.916 0.389 . . . . 0.70999999999999996 111.896 -179.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -71.79 -35.37 69.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.023 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.37 -7.93 59.63 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.464 0.706 . . . . 0.93000000000000005 112.366 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.21 -54.62 4.21 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 106.878 -1.527 . . . . 1.72 106.878 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.5 mt -75.03 -10.79 59.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 113.624 -1.625 . . . . 0.98999999999999999 110.093 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 49.3 t30 67.63 72.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.142 -0.935 . . . . 2.2000000000000002 111.104 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 t80 -82.88 127.08 33.17 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.239 -0.891 . . . . 1.23 109.039 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.419 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.6 tt -117.54 114.41 38.07 Favored Pre-proline 0 N--CA 1.445 -0.689 0 N-CA-C 108.608 -0.886 . . . . 1.8799999999999999 108.608 179.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 48' ' ' ILE . 3.6 Cg_exo -46.32 114.78 0.94 Allowed 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.854 2.37 . . . . 0.83999999999999997 112.253 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 54.4 t-20 -71.0 104.09 2.88 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.539 -0.755 . . . . 1.1000000000000001 109.88 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.543 ' O ' ' HG3' ' A' ' 55' ' ' GLN . 1.8 ptt180 -63.46 -29.08 70.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.722 -0.672 . . . . 4.7199999999999998 111.908 -179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 57.9 m -59.73 -54.12 50.01 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 109.501 -0.555 . . . . 0.77000000000000002 109.501 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.63 -40.89 89.11 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.741 -1.118 . . . . 0.66000000000000003 112.422 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.583 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 59.1 mt-30 -62.03 -65.41 0.69 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 107.963 -1.125 . . . . 1.46 107.963 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 16.4 mt-30 -44.51 -46.72 9.94 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 114.71 -1.132 . . . . 1.45 111.775 176.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.533 HD21 ' C2 ' ' C' ' 11' ' ' ' DG' . 66.5 tp -54.61 -50.92 66.9 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.888 0.699 . . . . 0.78000000000000003 112.888 -179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.64 -56.15 25.69 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.39 -0.524 . . . . 1.0800000000000001 110.963 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 179.36 51.55 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 118.854 -1.641 . . . . 1.6599999999999999 111.996 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -144.59 24.19 1.56 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.818 0.342 . . . . 4.79 110.125 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -45.61 99.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.899 -1.046 . . . . 2.3399999999999999 112.185 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.6 p -118.0 -32.56 4.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.66 -0.7 . . . . 3.8599999999999999 110.06 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.511 -0.757 . . . . 6.96 109.778 179.647 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.934 0.397 . . . . 6.9199999999999999 110.666 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.429 ' HE2' ' CG1' ' B' ' 4' ' ' VAL . 80.8 tttt -124.79 96.56 40.32 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.061 -0.518 . . . . 6.4199999999999999 110.494 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -87.61 87.42 0.63 Allowed 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.433 2.088 . . . . 2.1000000000000001 112.291 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.524 HG22 ' HA ' ' B' ' 47' ' ' TYR . 33.4 m -89.21 153.66 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.961 0.41 . . . . 1.4299999999999999 111.313 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.821 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 71.4 p -79.1 162.77 25.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.564 -0.743 . . . . 0.81000000000000005 110.8 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 47' ' ' TYR . 16.2 mt -71.91 -20.77 61.73 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.463 -0.569 . . . . 0.60999999999999999 109.463 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -66.81 -35.64 80.53 Favored 'General case' 0 CA--C 1.523 -0.081 0 N-CA-C 108.874 -0.787 . . . . 1.3200000000000001 108.874 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.81 -40.7 75.79 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.015 -0.993 . . . . 1.9399999999999999 108.828 178.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.7 t -60.53 -53.2 52.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 115.08 -0.964 . . . . 1.1399999999999999 110.371 179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.55 -35.73 72.79 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.829 -0.623 . . . . 0.71999999999999997 110.804 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -59.77 -43.76 94.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.617 -0.72 . . . . 1.8899999999999999 110.705 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.442 ' HB2' HD11 ' B' ' 45' ' ' LEU . 20.1 t80 -63.52 -52.92 59.16 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.165 -0.471 . . . . 1.46 110.9 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.458 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -66.24 -30.28 70.69 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 113.236 0.828 . . . . 0.67000000000000004 113.236 -178.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.12 46.59 6.53 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.109 -1.043 . . . . 1.21 111.397 -178.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 m -135.62 -177.78 2.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 109.958 -0.386 . . . . 0.71999999999999997 109.958 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.41 ' HB2' ' H72' ' D' ' 6' ' ' ' DT' . 60.3 p -92.44 154.07 18.73 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.613 -0.267 . . . . 1.1000000000000001 110.521 -179.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -58.87 -25.59 63.45 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 112.04 0.385 . . . . 1.49 112.04 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.556 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 25.4 tp60 -59.86 -57.36 13.22 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.254 0.55 . . . . 1.4299999999999999 111.121 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -20.86 64.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.937 -0.574 . . . . 0.78000000000000003 112.531 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.406 HG13 HD22 ' B' ' 6' ' ' LEU . 0.7 OUTLIER -71.33 -23.44 23.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.831 0.824 . . . . 1.0800000000000001 109.639 179.085 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.592 ' HB2' ' H72' ' C' ' 14' ' ' ' DT' . 25.3 t -84.16 -44.01 14.4 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.858 -1.064 . . . . 1.1200000000000001 108.29 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -58.78 -41.8 87.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.559 -1.2 . . . . 1.8799999999999999 111.646 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 38' ' ' VAL . 6.8 p -64.68 -44.59 96.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 C-N-CA 121.161 -0.215 . . . . 1.3899999999999999 111.504 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -68.4 -37.95 78.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.3 -0.63 . . . . 1.3100000000000001 109.3 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -69.91 -27.13 64.53 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.136 -0.938 . . . . 2.1899999999999999 109.589 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 40.2 43.44 1.38 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 124.726 1.266 . . . . 3.2999999999999998 111.357 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -161.83 64.2 0.25 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.404 -0.816 . . . . 3.0800000000000001 111.873 -178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -154.93 -91.16 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.301 -0.863 . . . . 3.25 109.881 178.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 14.5 m80 -150.79 27.49 0.71 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.685 -0.689 . . . . 1.75 110.454 178.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.412 HG11 ' HA ' ' B' ' 23' ' ' VAL . 0.2 OUTLIER -58.88 117.61 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.111 0 N-CA-C 112.421 0.526 . . . . 1.3500000000000001 112.421 -179.605 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.14 162.24 29.66 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.771 -0.455 . . . . 1.5800000000000001 109.771 177.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.53 -51.33 69.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.795 0.331 . . . . 1.27 110.321 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' B' ' 33' ' ' LYS . 35.6 mmtt -60.06 -38.65 83.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.395 -0.366 . . . . 2.2000000000000002 111.697 179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.4 m -60.67 -43.19 97.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.627 0.727 . . . . 1.05 109.764 177.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -63.0 -46.32 88.21 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.87 -1.059 . . . . 1.54 110.031 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -53.87 -54.63 35.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.151 -0.931 . . . . 1.97 111.133 -179.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.458 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 29.7 mttt -56.07 -47.77 77.33 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.699 0.629 . . . . 2.5 112.699 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.786 HG11 HG11 ' B' ' 23' ' ' VAL . 32.4 t -70.57 -33.93 55.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.597 -0.441 . . . . 1.3799999999999999 111.541 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -64.88 -40.44 95.12 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.026 -0.361 . . . . 2.0699999999999998 110.026 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.86 -47.75 79.47 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.98 -0.555 . . . . 0.91000000000000003 110.923 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.33 -41.18 96.92 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.783 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -31.88 73.1 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.728 -0.669 . . . . 1.3999999999999999 111.382 -179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.14 -50.17 12.48 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.374 0.509 . . . . 1.03 112.374 -179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -68.86 -43.05 76.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.516 -0.311 . . . . 2.1000000000000001 111.795 -178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' B' ' 12' ' ' TYR . 94.2 mt -81.44 -17.36 49.08 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.626 -0.43 . . . . 0.83999999999999997 110.864 -179.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.52 61.78 1.67 Allowed 'General case' 0 CA--C 1.527 0.075 0 CA-C-O 121.409 0.623 . . . . 1.5600000000000001 112.307 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.524 ' HA ' HG22 ' B' ' 4' ' ' VAL . 6.5 t80 -68.74 127.98 35.03 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.634 -0.506 . . . . 0.88 109.634 177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.5 mm -119.36 121.17 30.33 Favored Pre-proline 0 N--CA 1.448 -0.537 0 N-CA-C 108.476 -0.935 . . . . 1.6000000000000001 108.476 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.86 110.12 1.06 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.982 2.455 . . . . 1.45 113.4 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.437 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 42.8 t-20 -73.27 109.72 7.01 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 107.612 -1.255 . . . . 1.0900000000000001 107.612 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -63.04 -34.82 78.4 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.866 0.365 . . . . 3.3900000000000001 110.762 -177.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.437 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 7.6 m -65.83 -39.86 91.25 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 115.902 -0.59 . . . . 0.82999999999999996 111.068 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.421 ' HB3' " H5'" ' C' ' 12' ' ' ' DA' . . . -78.03 -45.63 23.15 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.895 -0.139 . . . . 0.63 111.046 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -51.54 -44.94 62.81 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.223 0.535 . . . . 1.3300000000000001 111.311 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.524 ' HB2' ' H ' ' B' ' 61' ' ' SER . 18.7 pt20 -78.06 -31.1 50.12 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.546 -0.752 . . . . 3.0299999999999998 112.171 -178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.414 HD21 " O4'" ' D' ' 12' ' ' ' DG' . 1.9 mt -72.92 -26.05 61.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.295 0.569 . . . . 1.21 110.061 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.58 6.32 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.769 1.396 . . . . 0.98999999999999999 114.769 -179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.34 -69.25 0.32 Allowed Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.869 -1.157 . . . . 2.0899999999999999 113.711 178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.28 91.17 3.6 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.707 0.289 . . . . 5.9199999999999999 111.328 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.476 ' HA ' ' HB2' ' B' ' 55' ' ' GLN . 4.6 mt-30 -61.26 128.96 38.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.106 -0.497 . . . . 4.8300000000000001 110.901 179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . 0.524 ' H ' ' HB2' ' B' ' 55' ' ' GLN . 0.7 OUTLIER -78.53 -13.13 59.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.84 -0.618 . . . . 6.0899999999999999 111.137 -179.584 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.279 0 CA-C-N 115.458 -0.792 . . . . 7.79 110.159 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.436 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 98.974 -2.661 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.457 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.308 0 C3'-C2'-C1' 99.356 -2.389 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.457 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.896 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.465 " H3'" ' H ' ' A' ' 31' ' ' SER . . . . . . . . 0 C2'--C1' 1.506 -1.102 0 C3'-C2'-C1' 99.637 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.401 ' C7 ' ' O ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.901 0 C3'-C2'-C1' 99.03 -2.622 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.462 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.86 0 C3'-C2'-C1' 99.655 -2.175 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.567 ' H71' ' HB2' ' A' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.51 -0.771 0 C3'-C2'-C1' 99.584 -2.226 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C3'-C2'-C1' 99.808 -2.066 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.724 0 C3'-C2'-C1' 99.274 -2.447 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.412 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.502 -1.326 0 C3'-C2'-C1' 99.88 -2.014 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.442 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.895 -2.004 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.821 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.639 -2.187 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.502 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 C3'-C2'-C1' 98.668 -2.88 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.59 -2.222 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.592 ' H72' ' HB2' ' B' ' 21' ' ' SER . . . . . . . . 0 C2'--C1' 1.51 -0.801 0 C3'-C2'-C1' 99.208 -2.494 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 C3'-C2'-C1' 99.646 -2.181 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 O4'-C1'-C2' 104.051 -1.863 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.532 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.864 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 99.207 -2.495 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.532 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.149 0 C3'-C2'-C1' 99.643 -2.184 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.852 -2.034 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C1'-C2' 103.651 -2.227 . . . . 1.8100000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.762 -2.098 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.545 0 C3'-C2'-C1' 101.48 -0.871 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.638 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.675 -2.161 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.638 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 C1'-O4'-C4' 110.494 0.567 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.56 " H5'" " H1'" ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.529 0.558 0 C3'-C2'-C1' 105.557 2.041 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.506 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 O4'-C1'-N19 108.267 0.584 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.401 H2'' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.705 0 C3'-C2'-C1' 105.138 1.741 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.556 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.758 0 N19-C1'-C2' 116.233 1.271 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.453 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.526 0.822 0 C1'-O4'-C4' 107.403 -1.641 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.75 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.925 0 C1'-O4'-C4' 107.571 -1.52 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.75 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 N19-C1'-C2' 115.202 0.626 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.434 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.44 0.706 0 C4'-C3'-O3' 113.866 1.621 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.434 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 C4'-C3'-C2' 104.367 1.167 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.482 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.185 0 N19-C1'-C2' 116.537 1.46 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.583 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O4'--C1' 1.407 -0.976 0 C1'-O4'-C4' 106.805 -2.068 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.401 " H5'" H2'' ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C3'-C2'-C1' 100.988 -1.223 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.758 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.827 0 C3'-C2'-C1' 105.605 2.075 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.758 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.36 0 C3'-C2'-C1' 101.168 -1.094 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.872 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.869 0 C3'-C2'-C1' 105.457 1.969 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.872 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.63 1.903 0 P-O3'-C3' 120.639 0.783 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.505 ' C6 ' ' H72' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 O4'-C1'-C2' 104.901 -1.09 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.505 ' H72' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 O4'-C1'-C2' 106.887 0.716 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.793 0.995 . . . . 2.1400000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.762 0 C3'-C2'-C1' 101.682 -0.727 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptm . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 109.852 -0.425 . . . . 5.7999999999999998 109.852 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -70.14 128.16 91.74 Favored Pre-proline 0 C--N 1.328 -0.35 0 O-C-N 123.429 0.456 . . . . 5.3499999999999996 110.77 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_exo -52.26 123.78 13.44 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.816 2.344 . . . . 2.4300000000000002 112.189 178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.588 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 1.5 t -62.77 140.28 19.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.148 -0.933 . . . . 1.03 110.282 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.8 p -97.17 179.86 4.76 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 120.974 0.416 . . . . 0.76000000000000001 111.441 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.53 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.4 pp -75.02 -21.89 58.81 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.942 -0.572 . . . . 0.98999999999999999 110.918 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -68.47 -36.74 79.39 Favored 'General case' 0 CA--C 1.511 -0.534 0 N-CA-C 108.423 -0.954 . . . . 1.51 108.423 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.556 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.4 m-20 -68.93 -49.21 60.06 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.267 -0.879 . . . . 1.6699999999999999 109.162 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.22 -40.64 66.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 114.511 -1.222 . . . . 0.70999999999999996 110.114 177.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.66 -48.56 81.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.297 0.57 . . . . 0.68000000000000005 111.153 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -63.04 -42.41 99.74 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.825 -0.625 . . . . 2.3999999999999999 111.064 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -68.12 -38.64 82.44 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 1.47 110.405 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.533 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -72.38 -26.61 61.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.176 -0.466 . . . . 0.77000000000000002 110.797 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.02 34.32 9.98 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.494 -0.86 . . . . 1.3700000000000001 113.026 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.3 m -146.78 -171.12 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.85 -0.426 . . . . 0.77000000000000002 109.85 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.5 m -77.37 -169.84 1.55 Allowed 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 120.935 0.398 . . . . 1.3300000000000001 110.332 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 44.4 p90 -94.67 -22.49 18.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.072 0.463 . . . . 1.3200000000000001 110.126 -177.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.591 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 5.4 tp-100 -68.5 -34.32 75.69 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.759 -0.655 . . . . 1.4399999999999999 110.461 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.37 -34.36 76.55 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.151 -0.931 . . . . 0.77000000000000002 109.55 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 23' ' ' VAL . 28.4 t -74.96 -52.02 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 115.513 -0.767 . . . . 1.3799999999999999 109.488 178.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.517 ' HA ' ' CG2' ' A' ' 24' ' ' VAL . 75.3 m -58.57 -22.85 57.08 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 114.223 1.194 . . . . 1.0800000000000001 114.223 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 22' ' ' ARG . 49.7 mtt85 -74.78 -23.91 58.59 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 121.859 -0.525 . . . . 2.5499999999999998 111.95 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 20' ' ' VAL . 16.0 m -90.14 -21.69 6.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 119.471 -0.892 . . . . 1.6299999999999999 111.365 -178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.74 -20.45 13.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.499 -0.48 . . . . 1.3799999999999999 110.212 178.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -105.03 8.96 34.54 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.862 -0.608 . . . . 1.6100000000000001 109.381 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 49.43 39.47 16.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.437 -1.256 . . . . 3.7000000000000002 110.956 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.75 121.93 23.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.054 -0.521 . . . . 2.1000000000000001 110.797 -179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.6 m -80.42 73.94 7.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.508 -0.769 . . . . 1.98 110.046 179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.429 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 0.1 OUTLIER -161.32 52.64 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.751 -0.658 . . . . 1.3799999999999999 110.58 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 t -153.82 148.66 13.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 1.1100000000000001 110.135 -178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.5 m -75.33 147.19 40.33 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.341 0.591 . . . . 1.3200000000000001 110.082 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.17 -47.64 62.1 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.717 0.636 . . . . 1.1299999999999999 112.717 -179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 ttpt -54.18 -51.83 63.13 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 1.75 111.223 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.599 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -68.99 -35.05 76.27 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.739 -0.664 . . . . 0.98999999999999999 111.686 -179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -58.72 -46.33 87.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.985 -0.552 . . . . 3.3399999999999999 110.604 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 29.8 mt-10 -70.98 -38.02 72.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.072 0.463 . . . . 1.76 110.383 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.533 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 37.4 ttmt -58.18 -50.56 73.1 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.585 -0.734 . . . . 1.45 112.401 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 34' ' ' THR . 3.4 m -62.79 -35.46 70.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.104 -0.498 . . . . 1.45 111.609 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' A' ' 42' ' ' MET . 41.0 mt-10 -76.72 -39.41 51.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.671 0.272 . . . . 1.8700000000000001 111.441 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.5 99.67 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.327 0.584 . . . . 0.88 110.416 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.37 -32.22 73.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.097 -0.956 . . . . 0.70999999999999996 111.505 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.704 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 23.3 ptm -76.41 -26.11 55.19 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 120.708 -0.397 . . . . 1.47 111.571 -178.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.55 -40.41 25.96 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 122.158 -0.339 . . . . 0.93000000000000005 110.629 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -61.75 -45.59 93.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.077 -0.51 . . . . 1.72 110.871 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.7 mt -86.89 -9.28 56.08 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.456 -0.793 . . . . 0.98999999999999999 111.765 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 61.55 59.04 1.92 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 2.2000000000000002 110.443 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.588 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.7 t80 -89.01 136.28 33.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.855 -0.612 . . . . 1.23 110.758 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 tt -126.16 122.26 24.12 Favored Pre-proline 0 N--CA 1.446 -0.666 0 N-CA-C 108.889 -0.782 . . . . 1.8799999999999999 108.889 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HB3' HG11 ' A' ' 24' ' ' VAL . 24.3 Cg_endo -60.33 126.26 19.59 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.694 2.263 . . . . 0.83999999999999997 113.278 -178.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.509 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 44.3 t-20 -71.13 104.58 3.1 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.277 0.56 . . . . 1.1000000000000001 109.512 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.581 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 1.6 mpt_? -68.48 -20.32 64.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.104 -0.498 . . . . 4.7199999999999998 111.988 -178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -75.99 -40.85 52.88 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.194 0.521 . . . . 0.77000000000000002 110.197 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.636 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -75.63 -34.33 60.53 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.383 -0.826 . . . . 0.66000000000000003 112.519 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.581 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.4 pt20 -73.22 -21.97 60.54 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.879 -0.328 . . . . 1.46 111.325 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -87.56 -35.61 18.03 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.569 -0.9 . . . . 1.45 108.569 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.65 HD22 HD13 ' B' ' 56' ' ' LEU . 26.5 tp -52.88 -39.89 63.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.695 -1.139 . . . . 0.78000000000000003 111.937 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.56 0.44 20.03 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.381 0.511 . . . . 1.0800000000000001 112.381 -179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -140.74 -103.0 0.51 Allowed Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.698 -0.961 . . . . 1.6599999999999999 110.698 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -132.4 140.36 48.44 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.651 0.738 . . . . 4.79 110.243 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.471 HE22 " H5'" ' C' ' 11' ' ' ' DG' . 9.5 mt-30 -112.05 -107.13 0.37 Allowed 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.105 -0.952 . . . . 2.3399999999999999 111.267 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.75 1.76 55.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 3.8599999999999999 110.922 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.131 -0.938 . . . . 6.96 110.052 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.3 mmm . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 110.199 -0.297 . . . . 6.9199999999999999 110.199 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -65.01 122.78 81.48 Favored Pre-proline 0 C--O 1.237 0.416 0 N-CA-C 110.305 -0.257 . . . . 6.4199999999999999 110.305 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -76.25 171.58 17.83 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.738 2.292 . . . . 2.1000000000000001 113.491 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 47' ' ' TYR . 0.9 OUTLIER -145.18 148.9 17.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 113.771 -1.559 . . . . 1.4299999999999999 107.035 179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.593 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 13.5 p -64.8 150.69 47.05 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 120.3 -0.56 . . . . 0.81000000000000005 111.099 -177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.499 HD22 ' CG1' ' B' ' 20' ' ' VAL . 8.5 mt -68.5 -18.37 64.37 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.483 -0.932 . . . . 0.60999999999999999 108.483 178.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -65.13 -42.3 94.02 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.068 -0.969 . . . . 1.3200000000000001 109.227 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -46.28 86.98 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.337 -0.847 . . . . 1.9399999999999999 110.425 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 5.4 t -60.02 -45.0 95.99 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 CA-C-N 115.604 -0.725 . . . . 1.1399999999999999 110.64 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.24 -46.35 88.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.101 -0.499 . . . . 0.71999999999999997 111.429 179.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -58.99 -46.75 87.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.442 -0.345 . . . . 1.8899999999999999 111.517 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -61.9 -41.62 98.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.027 0.442 . . . . 1.46 111.309 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -21.58 59.89 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.985 -0.552 . . . . 0.67000000000000004 112.367 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 43.13 10.88 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.322 -0.942 . . . . 1.21 111.207 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 8.8 m -144.37 177.75 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.144 0 C-N-CA 122.467 0.307 . . . . 0.71999999999999997 110.478 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 89.4 p -85.01 162.82 19.21 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.691 -0.404 . . . . 1.1000000000000001 111.374 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 85.7 t80 -54.84 -33.39 61.63 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.418 -0.81 . . . . 1.49 112.303 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.542 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 5.4 tt0 -74.55 -43.44 55.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 120.828 -0.349 . . . . 1.4299999999999999 111.764 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -41.32 67.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.765 0.317 . . . . 0.78000000000000003 110.551 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.499 ' CG1' HD22 ' B' ' 6' ' ' LEU . 1.1 t -61.61 -45.18 99.21 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.451 -0.795 . . . . 1.0800000000000001 109.979 178.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.17 -38.9 92.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.896 -0.593 . . . . 1.1200000000000001 110.794 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 30.6 mmt180 -53.19 -36.2 60.7 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 122.773 0.429 . . . . 1.8799999999999999 110.836 178.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.24 -51.38 53.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 CA-C-O 121.478 0.656 . . . . 1.3899999999999999 109.335 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -48.8 86.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 114.681 -1.145 . . . . 1.3100000000000001 111.3 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.3 p30 -81.61 11.21 4.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.723 -0.217 . . . . 2.1899999999999999 111.377 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 36.91 57.24 1.19 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.503 1.121 . . . . 3.2999999999999998 112.72 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.456 ' O ' ' HB2' ' B' ' 28' ' ' SER . . . -70.57 -11.15 60.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.112 -0.949 . . . . 3.0800000000000001 112.214 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 27' ' ' ALA . 13.1 m 71.95 -14.59 0.51 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.764 1.024 . . . . 3.25 113.764 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -93.82 45.12 1.14 Allowed 'General case' 0 C--N 1.322 -0.601 0 O-C-N 121.51 -0.744 . . . . 1.75 111.108 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -128.17 125.01 63.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.602 -0.726 . . . . 1.3500000000000001 110.077 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 55.9 m -58.33 146.7 33.54 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.368 0.418 . . . . 1.5800000000000001 110.358 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.27 -44.74 88.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.943 0.401 . . . . 1.27 110.53 -179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 26.2 mmtt -64.75 -29.35 70.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 2.2000000000000002 110.753 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -69.67 -44.09 71.2 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.347 0.594 . . . . 1.05 109.844 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.614 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 16.9 mtm180 -61.67 -36.15 80.0 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.505 -0.77 . . . . 1.54 109.483 178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' B' ' 33' ' ' LYS . 27.4 tt0 -52.14 -47.22 65.5 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.503 -0.771 . . . . 1.97 110.176 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -63.81 -55.98 18.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.229 -0.896 . . . . 2.5 111.051 179.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 59.6 t -54.36 -42.24 57.0 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 112.072 0.397 . . . . 1.3799999999999999 112.072 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 78.4 mt-10 -62.6 -36.22 82.04 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-O 120.829 0.347 . . . . 2.0699999999999998 110.242 -179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.606 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -67.7 -51.61 47.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.854 -0.612 . . . . 0.91000000000000003 109.502 178.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.74 88.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.72999999999999998 110.626 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 5.1 mtm -52.95 -49.49 65.95 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.881 -0.599 . . . . 1.3999999999999999 111.717 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.23 -32.95 44.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.798 0.332 . . . . 1.03 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . 0.606 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -68.51 -40.79 80.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.048 -0.524 . . . . 2.1000000000000001 112.144 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 71.3 mt -97.39 -12.16 23.09 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.081 0.4 . . . . 0.83999999999999997 112.081 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 68.26 62.04 0.38 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.091 0.472 . . . . 1.5600000000000001 111.011 179.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.49 ' HA ' ' CG1' ' B' ' 4' ' ' VAL . 38.3 t80 -76.13 125.15 28.61 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.136 0.493 . . . . 0.88 111.477 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 38.2 mm -128.61 131.96 24.07 Favored Pre-proline 0 N--CA 1.443 -0.822 0 N-CA-C 108.43 -0.952 . . . . 1.6000000000000001 108.43 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -62.18 108.7 0.71 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 121.992 1.794 . . . . 1.45 112.03 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -67.35 99.02 0.68 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.615 -0.721 . . . . 1.0900000000000001 109.142 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -57.03 -26.73 60.79 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.055 -0.521 . . . . 3.3900000000000001 111.863 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.5 m -68.32 -47.99 66.08 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.456 0.17 . . . . 0.82999999999999996 110.575 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.46 -32.28 54.32 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.72 -0.474 . . . . 0.63 109.72 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.57 -52.74 63.87 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.807 0.336 . . . . 1.3300000000000001 111.477 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.762 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -64.08 -28.98 70.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.276 0.56 . . . . 3.0299999999999998 111.212 -179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.65 HD13 HD22 ' A' ' 56' ' ' LEU . 2.8 mt -80.04 -31.28 39.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.125 -0.943 . . . . 1.21 110.094 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.2 -5.93 39.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.814 -0.63 . . . . 0.98999999999999999 111.54 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 117.6 24.39 3.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.538 -0.839 . . . . 2.0899999999999999 113.786 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.762 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 4.3 mttp -117.48 98.46 6.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.555 0.693 . . . . 5.9199999999999999 110.228 178.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -138.81 124.76 19.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.98 -1.009 . . . . 4.8300000000000001 110.948 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.81 -7.08 53.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.247 -0.433 . . . . 6.0899999999999999 110.264 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 C--O 1.246 0.875 0 CA-C-N 115.129 -0.941 . . . . 7.79 110.709 -179.902 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.53 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.206 0 C3'-C2'-C1' 99.18 -2.514 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.502 -1.328 0 C3'-C2'-C1' 99.395 -2.361 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.47 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.712 0 C3'-C2'-C1' 99.354 -2.39 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.625 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C3'-C2'-C1' 98.979 -2.658 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.625 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 98.973 -2.662 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.55 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.512 -0.676 0 C3'-C2'-C1' 99.79 -2.078 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.591 ' H71' ' HB2' ' A' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.511 -0.727 0 C3'-C2'-C1' 99.558 -2.245 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.826 0 C3'-C2'-C1' 99.197 -2.502 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.296 0 C3'-C2'-C1' 99.64 -2.186 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 O4'-C1'-C2' 104.071 -1.845 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.537 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C3'-C2'-C1' 99.718 -2.13 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.593 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.425 -0.936 0 C3'-C2'-C1' 98.976 -2.66 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.897 0 O4'-C1'-C2' 103.929 -1.973 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.53 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.015 0 C3'-C2'-C1' 99.62 -2.2 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.53 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.846 0 C3'-C2'-C1' 99.654 -2.176 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.859 0 C3'-C2'-C1' 99.877 -2.017 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.409 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.285 -2.44 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.495 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.64 0 C3'-C2'-C1' 99.772 -2.092 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.604 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 O4'-C1'-C2' 103.995 -1.914 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.604 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.905 0 C3'-C2'-C1' 99.641 -2.185 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.331 -2.406 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C1'-O4'-C4' 110.87 0.836 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.516 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 99.454 -2.318 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.516 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.712 0 C5'-C4'-C3' 115.805 0.736 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.505 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 C4'-C3'-C2' 104.26 1.06 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.505 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.87 0 O4'-C1'-C2' 104.904 -1.088 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.554 " C2'" ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.538 0 C4'-C3'-C2' 102.409 -0.791 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.554 ' H72' " C2'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 O4'-C1'-C2' 107.394 1.177 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.443 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.999 0 O4'-C1'-C2' 104.869 -1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.483 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C3'-C2'-C1' 105.431 1.951 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.531 ' C5 ' ' H73' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 C3'-C2'-C1' 101.152 -1.106 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.531 ' H73' ' C5 ' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.512 -0.619 0 N19-C1'-C2' 116.204 1.253 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 N19-C1'-C2' 113.493 -0.442 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.58 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.529 1.13 0 C3'-C2'-C1' 105.391 1.922 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.509 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 P--O3' 1.598 -0.773 0 C3'-C2'-C1' 105.153 1.752 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.435 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-C2' 104.705 -1.268 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.435 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.614 0.544 0 O4'-C1'-C2' 107.199 0.999 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.439 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 C3'-C2'-C1' 100.443 -1.612 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.52 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.765 0 O4'-C1'-C2' 105.011 -0.99 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.73 0 C4'-C3'-C2' 102.05 -1.15 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 N19-C1'-C2' 115.081 0.551 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.432 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.785 0 C4'-C3'-C2' 104.629 1.429 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.468 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.932 0 O4'-C1'-C2' 104.366 -1.576 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.468 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 C3'-C2'-C1' 100.165 -1.811 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.6 mtt . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 120.978 0.418 . . . . 5.7999999999999998 110.978 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -90.51 134.44 30.96 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.83 -0.623 . . . . 5.3499999999999996 110.294 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -77.96 53.38 4.41 Favored 'Trans proline' 0 CA--C 1.528 0.179 0 C-N-CA 122.924 2.416 . . . . 2.4300000000000002 112.857 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.473 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 10.0 t -84.04 138.38 19.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.797 -0.638 . . . . 1.03 110.987 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 9' ' ' VAL . 77.6 p -97.17 177.88 5.43 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.691 0.281 . . . . 0.76000000000000001 110.451 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.567 HD23 ' H ' ' A' ' 6' ' ' LEU . 2.5 pt? -70.49 -20.3 62.87 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 121.996 -0.44 . . . . 0.98999999999999999 111.247 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -72.25 -36.51 69.1 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 120.351 -0.54 . . . . 1.51 110.845 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.463 ' HB3' ' CG1' ' A' ' 4' ' ' VAL . 38.9 t70 -70.39 -45.91 65.06 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.481 0.658 . . . . 1.6699999999999999 109.732 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' THR . 13.0 t -58.66 -36.11 58.58 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 CA-C-N 115.064 -0.971 . . . . 0.70999999999999996 109.39 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.19 -55.54 27.61 Favored 'General case' 0 C--O 1.254 1.334 0 C-N-CA 122.773 0.429 . . . . 0.68000000000000005 111.212 178.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -58.22 -43.86 87.92 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 115.911 -0.586 . . . . 2.3999999999999999 111.196 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 44' ' ' GLU . 44.9 t80 -67.47 -35.8 79.9 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.661 0.384 . . . . 1.47 110.884 179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.75 -23.5 55.99 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.358 0.599 . . . . 0.77000000000000002 112.001 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.45 34.65 11.63 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.419 -0.896 . . . . 1.3700000000000001 112.291 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 m -145.37 -169.53 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 109.633 -0.506 . . . . 0.77000000000000002 109.633 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 95.9 p -81.8 -162.51 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.913 -0.773 . . . . 1.3300000000000001 108.913 178.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.408 ' O ' HD12 ' A' ' 6' ' ' LEU . 13.6 p90 -102.38 -4.55 25.35 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.462 0.649 . . . . 1.3200000000000001 111.059 -179.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.1 tp-100 -82.65 -28.97 30.35 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.249 -0.58 . . . . 1.4399999999999999 110.511 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.74 -39.96 90.65 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.737 -0.665 . . . . 0.77000000000000002 111.591 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' A' ' 6' ' ' LEU . 35.8 m -74.5 -47.29 40.17 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 O-C-N 121.752 -0.593 . . . . 1.3799999999999999 110.299 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.9 t -60.14 -31.08 69.75 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 122.048 -0.408 . . . . 1.0800000000000001 111.955 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -67.21 -26.04 66.41 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.247 0.546 . . . . 2.5499999999999998 110.26 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.7 t -87.0 -33.67 7.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.263 0.554 . . . . 1.6299999999999999 110.337 179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.4 t -64.6 -26.73 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.787 -0.642 . . . . 1.3799999999999999 110.081 177.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -97.86 10.57 39.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.075 0.464 . . . . 1.6100000000000001 110.79 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 45.26 40.84 5.51 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.079 -0.964 . . . . 3.7000000000000002 112.128 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.06 119.41 31.19 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 116.318 -0.401 . . . . 2.1000000000000001 110.777 -179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.2 t -78.33 78.08 4.81 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.622 -0.717 . . . . 1.98 111.267 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 41.33 0.47 Allowed 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.801 -0.815 . . . . 1.3799999999999999 108.801 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t -147.26 150.94 14.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 115.533 -0.758 . . . . 1.1100000000000001 109.624 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.534 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 74.0 m -66.36 141.35 58.0 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 116.683 -0.235 . . . . 1.3200000000000001 110.631 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.477 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -51.29 -42.55 61.22 Favored 'General case' 0 C--O 1.248 1.001 0 O-C-N 123.305 0.378 . . . . 1.1299999999999999 111.671 178.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -56.89 -48.69 77.61 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.09 0.471 . . . . 1.75 111.528 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.534 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.1 OUTLIER -68.67 -32.72 72.76 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 115.807 -0.633 . . . . 0.98999999999999999 110.683 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 10.4 ttp180 -63.54 -48.77 76.11 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.754 0.659 . . . . 3.3399999999999999 109.271 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 48.5 mt-10 -63.51 -41.52 98.52 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.04 -0.726 . . . . 1.76 109.04 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.2 ttmt -52.24 -52.95 49.44 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 115.638 -0.71 . . . . 1.45 110.652 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.1 t -60.36 -48.44 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.45 -1.25 . . . . 1.45 112.339 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 27.1 mt-10 -61.84 -38.92 90.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.766 0.284 . . . . 1.8700000000000001 111.766 -179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.56 -43.96 58.59 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.081 -0.248 . . . . 0.88 110.377 178.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.64 -41.43 94.93 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 122.228 1.013 . . . . 0.70999999999999996 110.409 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.441 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 5.3 ptp -67.95 -27.42 66.59 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.318 -0.855 . . . . 1.47 111.641 -179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -84.2 -39.09 19.77 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.492 -0.322 . . . . 0.93000000000000005 110.743 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 12' ' ' TYR . 13.7 tp10 -62.95 -46.16 89.06 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.806 -0.442 . . . . 1.72 109.806 179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.5 mt -83.22 -13.17 55.92 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.98999999999999999 111.538 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 58.26 65.68 1.23 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.935 0.874 . . . . 2.2000000000000002 110.31 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.473 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.6 t80 -91.56 133.69 35.31 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.505 -1.225 . . . . 1.23 110.408 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.8 tt -130.92 118.94 17.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.111 -0.7 . . . . 1.8799999999999999 109.111 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.697 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 9.5 Cg_endo -56.99 131.22 44.12 Favored 'Trans proline' 0 C--O 1.242 0.724 0 C-N-CA 121.462 1.441 . . . . 0.83999999999999997 113.667 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 10.4 t30 -80.96 110.37 16.43 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.582 -0.735 . . . . 1.1000000000000001 110.214 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.3 mtm180 -63.97 -23.62 67.41 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 113.286 0.847 . . . . 4.7199999999999998 113.286 -177.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.4 m -64.17 -38.36 90.78 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.79 -0.764 . . . . 0.77000000000000002 109.193 178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.49 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -82.14 -31.47 30.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.119 -0.491 . . . . 0.66000000000000003 109.833 179.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 52.3 mt-30 -64.08 -36.82 85.27 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.39 -0.823 . . . . 1.46 109.763 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.577 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 77.6 mt-30 -89.09 -18.26 27.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.18 0.514 . . . . 1.45 110.776 -179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.727 HD22 HD13 ' B' ' 56' ' ' LEU . 25.2 tp -63.43 -33.55 75.8 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 115.038 -0.983 . . . . 0.78000000000000003 110.387 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.13 12.52 0.11 Allowed 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.704 -0.68 . . . . 1.0800000000000001 112.599 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.426 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 94.93 56.44 1.31 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.004 -0.617 . . . . 1.6599999999999999 112.484 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 0.3 OUTLIER -148.99 16.84 0.96 Allowed 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.993 0.467 . . . . 4.79 110.591 -179.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.518 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 22.9 mp0 -48.14 141.18 6.46 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.076 1.139 . . . . 2.3399999999999999 114.076 -178.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.9 p -105.09 -3.22 23.37 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 114.804 -1.089 . . . . 3.8599999999999999 111.001 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.419 ' OXT' ' HG ' ' A' ' 62' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.242 0.676 0 CA-C-O 118.574 -0.727 . . . . 6.96 110.004 179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.8 ttt . . . . . 0 N--CA 1.489 1.51 0 CA-C-O 121.357 0.598 . . . . 6.9199999999999999 110.618 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -128.27 103.95 20.21 Favored Pre-proline 0 C--O 1.222 -0.354 0 CA-C-N 115.71 -0.677 . . . . 6.4199999999999999 110.013 -179.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -68.91 92.06 0.44 Allowed 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.697 2.265 . . . . 2.1000000000000001 112.581 -178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.45 HG22 ' HA ' ' B' ' 47' ' ' TYR . 30.3 m -89.67 156.36 3.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.913 -0.585 . . . . 1.4299999999999999 110.974 178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.406 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 23.0 p -77.05 159.37 29.91 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.508 -0.769 . . . . 0.81000000000000005 110.607 -177.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.3 mt -66.62 -22.23 66.12 Favored 'General case' 0 C--O 1.249 1.058 0 O-C-N 123.713 0.633 . . . . 0.60999999999999999 109.439 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -66.17 -45.91 79.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.941 -1.027 . . . . 1.3200000000000001 110.555 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -44.56 93.25 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.264 -0.88 . . . . 1.9399999999999999 111.313 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 5' ' ' THR . 2.9 t -61.6 -39.97 84.97 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 CA-C-O 121.12 0.486 . . . . 1.1399999999999999 110.931 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.38 -47.71 78.38 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 112.816 0.673 . . . . 0.71999999999999997 112.816 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.97 -33.02 71.54 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.713 -0.395 . . . . 1.8899999999999999 111.636 -177.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.426 ' CE1' HD21 ' B' ' 45' ' ' LEU . 1.2 t80 -59.97 -49.36 78.0 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 123.112 1.434 . . . . 1.46 108.83 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.28 -17.56 60.27 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 112.649 -2.068 . . . . 0.67000000000000004 111.887 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 102.56 -56.75 0.63 Allowed Glycine 0 C--O 1.218 -0.871 0 N-CA-C 111.671 -0.572 . . . . 1.21 111.671 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 30.6 m -52.38 177.7 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 115.502 1.667 . . . . 0.71999999999999997 115.502 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.2 p -88.81 167.9 12.89 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 112.97 -1.923 . . . . 1.1000000000000001 112.046 -177.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -60.6 -35.62 76.58 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 113.716 -1.584 . . . . 1.49 111.117 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.478 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 11.9 tp60 -62.18 -51.87 66.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.929 -1.032 . . . . 1.4299999999999999 111.629 -179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -38.39 90.97 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.912 0.387 . . . . 0.78000000000000003 111.791 -179.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.46 -44.08 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 116.328 -0.397 . . . . 1.0800000000000001 110.823 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.51 84.09 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.17 0.509 . . . . 1.1200000000000001 110.261 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.686 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 81.5 mtt180 -62.29 -51.62 66.97 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.836 -0.62 . . . . 1.8799999999999999 110.255 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.541 HG13 ' HB2' ' B' ' 35' ' ' ARG . 90.5 t -58.62 -44.54 89.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.677 0.751 . . . . 1.3899999999999999 110.557 179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.21 -32.36 57.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 114.982 -1.008 . . . . 1.3100000000000001 111.222 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.07 -44.59 60.37 Favored 'General case' 0 N--CA 1.446 -0.639 0 O-C-N 122.202 -0.311 . . . . 2.1899999999999999 110.877 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 168.75 -48.43 0.01 OUTLIER 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.073 -0.967 . . . . 3.2999999999999998 108.789 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.686 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . -177.58 -66.77 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.363 0 CA-C-N 114.929 -1.032 . . . . 3.0800000000000001 111.016 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.529 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 72.7 m 44.77 64.09 1.48 Allowed 'General case' 0 C--N 1.311 -1.066 0 O-C-N 124.103 0.877 . . . . 3.25 113.197 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . 0.451 ' CD2' ' H71' ' D' ' 3' ' ' ' DT' . 32.1 m80 70.1 52.76 0.37 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 121.744 0.783 . . . . 1.75 111.846 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.436 HG11 HG22 ' B' ' 23' ' ' VAL . 55.4 t -131.61 132.91 62.15 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 115.462 -0.79 . . . . 1.3500000000000001 112.106 176.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 3.1 m -73.48 151.64 40.99 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 115.615 -0.72 . . . . 1.5800000000000001 110.671 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.691 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -51.03 -53.17 36.01 Favored 'General case' 0 C--O 1.242 0.695 0 N-CA-C 113.924 1.083 . . . . 1.27 113.924 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 tptp -59.42 -33.59 71.44 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-O 121.223 0.535 . . . . 2.2000000000000002 110.538 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 33.9 m -64.46 -44.29 91.55 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-N 116.421 -0.354 . . . . 1.05 111.018 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 12.7 ptp180 -69.98 -34.18 73.04 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.003 -0.544 . . . . 1.54 111.024 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -54.67 -52.16 63.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 116.1 -0.5 . . . . 1.97 110.825 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 mtpp -59.6 -50.79 72.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.166 -0.47 . . . . 2.5 110.648 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 86.3 t -55.19 -40.83 57.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 N-CA-C 112.549 0.574 . . . . 1.3799999999999999 112.549 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 51.5 mt-10 -71.13 -29.01 64.7 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 109.258 -0.645 . . . . 2.0699999999999998 109.258 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.74 70.49 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.155 -0.683 . . . . 0.91000000000000003 109.155 177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.36 -33.76 71.82 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 116.35 -0.386 . . . . 0.72999999999999998 111.515 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.8 ttm -55.35 -47.94 74.99 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.561 0.208 . . . . 1.3999999999999999 111.561 178.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -39.23 31.07 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 116.192 -0.458 . . . . 1.03 110.964 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -60.26 -48.23 82.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 2.1000000000000001 111.011 -178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.426 HD21 ' CE1' ' B' ' 12' ' ' TYR . 64.1 mt -86.15 -12.86 48.79 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 123.696 0.623 . . . . 0.83999999999999997 112.46 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . 0.532 ' OD1' HD11 ' B' ' 48' ' ' ILE . 6.6 t-20 63.77 58.61 1.24 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 117.751 0.25 . . . . 1.5600000000000001 111.599 -178.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 4' ' ' VAL . 13.2 t80 -66.05 121.29 14.8 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.378 -0.601 . . . . 0.88 109.378 179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.532 HD11 ' OD1' ' B' ' 46' ' ' ASN . 22.6 mm -113.27 118.74 43.47 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.67 -1.233 . . . . 1.6000000000000001 107.67 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -65.58 122.21 9.8 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.0 1.8 . . . . 1.45 112.238 -178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.4 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 28.3 t30 -82.26 98.33 8.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.592 -0.731 . . . . 1.0900000000000001 109.137 179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.495 ' HD3' ' OE1' ' B' ' 54' ' ' GLN . 1.9 tpp180 -53.97 -37.5 64.03 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 119.318 -0.372 . . . . 3.3900000000000001 111.694 -178.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.436 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 7.2 m -58.42 -39.03 78.66 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 122.314 0.245 . . . . 0.82999999999999996 110.936 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -77.79 -43.21 31.38 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.481 0.181 . . . . 0.63 111.125 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.495 ' OE1' ' HD3' ' B' ' 51' ' ' ARG . 95.3 mt-30 -55.34 -44.36 75.85 Favored 'General case' 0 C--N 1.331 -0.21 0 O-C-N 123.845 0.716 . . . . 1.3300000000000001 111.142 179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.426 ' HB2' ' H ' ' B' ' 61' ' ' SER . 0.0 OUTLIER -73.69 -37.49 65.18 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.4 -0.818 . . . . 3.0299999999999998 111.623 -179.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.727 HD13 HD22 ' A' ' 56' ' ' LEU . 1.4 mt -76.65 -26.17 54.58 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.193 -0.458 . . . . 1.21 110.417 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.9 75.51 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 109.079 -0.711 . . . . 0.98999999999999999 109.079 -179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -165.42 -71.0 0.03 OUTLIER Glycine 0 N--CA 1.435 -1.375 0 C-N-CA 118.132 -1.985 . . . . 2.0899999999999999 112.451 172.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 74.16 2.95 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 112.663 0.616 . . . . 5.9199999999999999 112.663 -178.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -46.46 131.54 10.88 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.679 -0.691 . . . . 4.8300000000000001 110.905 177.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . 0.47 ' O ' ' HB2' ' B' ' 62' ' ' LEU . 15.6 m -132.94 108.61 9.03 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.676 -0.49 . . . . 6.0899999999999999 109.676 179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' B' ' 61' ' ' SER . 85.1 mt . . . . . 0 C--O 1.251 1.172 0 O-C-N 124.417 1.073 . . . . 7.79 110.501 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.46 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.121 -2.557 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.534 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.598 0 O4'-C1'-C2' 104.143 -1.779 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.534 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.684 0 C3'-C2'-C1' 99.278 -2.444 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.606 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.974 0 C3'-C2'-C1' 99.636 -2.188 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.606 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.642 -2.184 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.488 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.462 1.422 0 O4'-C1'-C2' 103.997 -1.912 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.488 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.616 -2.203 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.437 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-C2' 103.705 -2.177 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.437 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.496 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.147 0 O4'-C1'-C2' 103.716 -2.167 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.496 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.241 0 C3'-C2'-C1' 100.046 -1.896 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.678 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 P--O3' 1.628 1.72 0 C3'-C2'-C1' 99.918 -1.987 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.584 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.011 0 C3'-C2'-C1' 98.903 -2.712 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.673 0 C3'-C2'-C1' 99.389 -2.365 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.561 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.111 0 C3'-C2'-C1' 99.768 -2.094 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.561 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.911 0 C3'-C2'-C1' 99.381 -2.371 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.004 0 C3'-C2'-C1' 99.45 -2.321 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.61 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.88 0 C3'-C2'-C1' 99.746 -2.11 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.61 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.791 -2.792 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.503 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.98 0 O4'-C1'-C2' 104.067 -1.848 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.621 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 99.606 -2.21 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.621 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -0.971 0 C3'-C2'-C1' 98.723 -2.84 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.4 ' H8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.235 0 C3'-C2'-C1' 99.48 -2.3 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 N19-C1'-C2' 116.07 1.169 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.485 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.519 0.998 0 C3'-C2'-C1' 98.911 -2.707 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.485 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.11 0 C3'-C2'-C1' 100.923 -1.269 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.646 H2'' ' H71' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 100.04 -1.9 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.646 ' H71' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.991 0 O4'-C1'-N19 108.899 1.374 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.608 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.13 0 C3'-C2'-C1' 105.205 1.789 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.608 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.532 0.81 0 C3'-C2'-C1' 105.988 2.349 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.532 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.918 0 O4'-C1'-C2' 104.89 -1.1 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.042 0 C3'-C2'-C1' 105.51 2.007 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.481 ' C6 ' " H2'" ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.417 -1.439 0 C1'-O4'-C4' 110.427 0.52 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.65 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.419 -1.317 0 C3'-C2'-C1' 99.306 -2.424 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.65 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.536 0.785 0 C4'-C3'-C2' 104.902 1.702 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.565 " H4'" HD22 ' A' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 N19-C1'-C2' 115.872 1.045 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.697 ' OP1' ' HA ' ' A' ' 49' ' ' PRO . . . . . . . . 0 O4'--C1' 1.399 -1.591 0 C1'-O4'-C4' 106.902 -1.998 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.507 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 O4'-C1'-C2' 104.884 -1.105 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.634 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.877 0 C3'-C2'-C1' 106.081 2.415 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.634 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.623 1.317 0 C3'-C2'-C1' 104.841 1.529 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.46 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-C2' 105.043 -0.961 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.025 0 O4'-C4'-C3' 106.372 0.772 . . . . 1.5600000000000001 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.579 ' C6 ' ' H72' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.675 0 N19-C1'-C2' 115.757 0.973 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.579 ' H72' ' C6 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-N19 108.291 0.613 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.498 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.839 0 C3'-C2'-C1' 99.897 -2.002 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.42 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 104.497 1.297 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptt? . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.423 -0.214 . . . . 5.7999999999999998 110.423 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt 62.9 96.16 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.327 0 C-N-CA 123.118 0.567 . . . . 5.3499999999999996 111.377 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.17 176.7 5.99 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.523 2.149 . . . . 2.4300000000000002 112.859 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.6 OUTLIER -121.2 135.46 61.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.123 -0.944 . . . . 1.03 108.882 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.4 p -100.45 -174.7 2.72 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.584 -0.446 . . . . 0.76000000000000001 110.367 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.403 ' HB2' ' CG1' ' A' ' 20' ' ' VAL . 1.8 pp -76.61 -17.98 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.702 -0.681 . . . . 0.98999999999999999 111.591 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -73.43 -36.11 65.89 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.04 -0.726 . . . . 1.51 109.04 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HB2' HG12 ' A' ' 4' ' ' VAL . 18.6 m-20 -66.75 -53.2 35.67 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.747 -1.115 . . . . 1.6699999999999999 108.707 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 85.1 t -56.14 -42.28 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 114.858 -1.064 . . . . 0.70999999999999996 110.225 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -50.8 72.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.676 -0.693 . . . . 0.68000000000000005 111.752 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -61.76 -42.95 99.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.109 0.48 . . . . 2.3999999999999999 110.444 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -64.22 -39.04 93.15 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.704 -0.68 . . . . 1.47 109.715 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.28 -25.77 64.42 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.293 -0.867 . . . . 0.77000000000000002 111.593 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.14 36.68 17.31 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.277 -0.964 . . . . 1.3700000000000001 112.624 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.6 m -142.79 -169.34 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.835 -0.431 . . . . 0.77000000000000002 109.835 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 77.1 p -73.22 -175.04 1.75 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.393 -0.595 . . . . 1.3300000000000001 109.393 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.402 ' O ' HD13 ' A' ' 6' ' ' LEU . 41.9 p90 -93.58 -0.86 56.05 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.342 -0.543 . . . . 1.3200000000000001 111.075 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -101.99 -24.97 13.92 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.662 -0.415 . . . . 1.4399999999999999 110.578 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -37.91 79.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.966 -0.383 . . . . 0.77000000000000002 109.966 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.496 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 4.1 p -69.07 -41.87 81.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 N-CA-C 109.175 -0.676 . . . . 1.3799999999999999 109.175 177.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.7 t -62.96 -30.33 71.49 Favored 'General case' 0 C--O 1.226 -0.17 0 CA-C-N 116.191 -0.459 . . . . 1.0800000000000001 111.349 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.3 mpt_? -55.3 -26.13 38.47 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.038 0.384 . . . . 2.5499999999999998 112.038 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.32 -28.5 4.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.159 0.504 . . . . 1.6299999999999999 110.265 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 t -67.36 -26.68 36.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.613 -0.721 . . . . 1.3799999999999999 111.052 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.64 15.62 15.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.989 0.423 . . . . 1.6100000000000001 110.098 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 44.88 53.12 7.72 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.078 -0.965 . . . . 3.7000000000000002 113.263 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.411 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -64.37 123.81 20.15 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 120.856 0.36 . . . . 2.1000000000000001 111.531 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 m -84.15 58.12 4.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.053 0.454 . . . . 1.98 110.78 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -160.51 57.92 0.33 Allowed 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.784 -0.821 . . . . 1.3799999999999999 108.784 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -143.97 138.93 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.058 -0.519 . . . . 1.1100000000000001 110.795 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.57 145.29 39.09 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.574 -0.739 . . . . 1.3200000000000001 109.844 178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -50.65 -47.12 58.66 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 113.227 0.825 . . . . 1.1299999999999999 113.227 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -55.78 -51.41 67.52 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.028 0.442 . . . . 1.75 112.004 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.604 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -66.13 -32.52 74.01 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.438 -0.346 . . . . 0.98999999999999999 110.64 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -52.08 63.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.322 -0.399 . . . . 3.3399999999999999 110.457 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 54.1 mt-10 -54.5 -39.42 67.56 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.099 0.476 . . . . 1.76 110.4 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -57.37 -51.82 67.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.199 -0.91 . . . . 1.45 110.418 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 34' ' ' THR . 52.1 t -65.01 -46.38 91.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 114.622 -1.172 . . . . 1.45 111.276 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -57.85 -50.32 73.72 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.118 -0.492 . . . . 1.8700000000000001 111.758 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.43 87.56 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.941 0.401 . . . . 0.88 111.706 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.38 -44.07 68.8 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.012 0.745 . . . . 0.70999999999999996 113.012 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 14.4 ptt? -69.09 -32.84 72.55 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.888 -0.325 . . . . 1.47 111.211 -178.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.53 -35.67 53.09 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.134 -0.226 . . . . 0.93000000000000005 111.045 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -58.69 -55.18 38.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.829 0.347 . . . . 1.72 111.535 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.84 -22.07 59.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.333 -0.394 . . . . 0.98999999999999999 111.45 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 59.8 t30 62.86 71.87 0.51 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.758 0.79 . . . . 2.2000000000000002 110.666 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -98.49 140.93 32.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.441 -0.799 . . . . 1.23 110.851 -179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.439 HD13 ' HA ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -116.6 119.39 35.91 Favored Pre-proline 0 N--CA 1.447 -0.606 0 N-CA-C 108.608 -0.886 . . . . 1.8799999999999999 108.608 179.645 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -53.88 117.61 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.337 0 C-N-CA 122.638 2.225 . . . . 0.83999999999999997 111.851 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.488 HD22 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -66.48 106.36 1.74 Allowed 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.379 -0.6 . . . . 1.1000000000000001 109.379 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 0.5 OUTLIER -64.06 -13.43 47.13 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.553 0.946 . . . . 4.7199999999999998 113.553 -177.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.57 -41.19 93.17 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.252 -0.579 . . . . 0.77000000000000002 110.48 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.565 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.28 -24.35 37.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.968 -0.56 . . . . 0.66000000000000003 110.002 178.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.549 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 20.1 mm-40 -57.63 -38.89 75.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.069 -0.969 . . . . 1.46 111.678 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -88.24 -38.76 14.98 Favored 'General case' 0 N--CA 1.448 -0.525 0 N-CA-C 109.47 -0.567 . . . . 1.45 109.47 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.638 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 34.4 tp -49.76 -51.59 37.97 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 124.598 1.186 . . . . 0.78000000000000003 112.135 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.38 -8.67 23.04 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.932 -0.766 . . . . 1.0800000000000001 108.932 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . -70.85 -58.17 5.92 Favored Glycine 0 N--CA 1.438 -1.169 0 CA-C-N 114.712 -1.131 . . . . 1.6599999999999999 113.66 -178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 60' ' ' GLN . 11.3 mtpp 163.12 -12.77 0.0 OUTLIER 'General case' 0 C--N 1.349 0.55 0 C-N-CA 125.146 1.378 . . . . 4.79 108.329 -177.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER 88.92 -12.19 0.41 Allowed 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 113.919 -1.491 . . . . 2.3399999999999999 111.853 178.679 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -95.16 10.34 36.27 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.323 0.583 . . . . 3.8599999999999999 110.634 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-N 115.533 -0.758 . . . . 6.96 111.53 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 109.416 -0.587 . . . . 6.9199999999999999 109.416 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 42.6 mtmt -76.68 118.82 74.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.669 -0.241 . . . . 6.4199999999999999 110.809 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.56 ' HA ' HG12 ' B' ' 48' ' ' ILE . 83.4 Cg_endo -83.98 -5.63 10.48 Favored 'Trans proline' 0 N--CA 1.456 -0.7 0 C-N-CA 121.986 1.791 . . . . 2.1000000000000001 112.142 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' B' ' 47' ' ' TYR . 10.1 m 45.48 -153.96 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.608 1.193 . . . . 1.4299999999999999 112.143 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.639 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 40.4 p -142.66 160.26 40.64 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.091 -0.337 . . . . 0.81000000000000005 110.091 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.612 HD22 HG11 ' B' ' 20' ' ' VAL . 7.6 mt -68.21 -18.79 64.67 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.273 -1.01 . . . . 0.60999999999999999 108.273 178.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . 0.512 ' CD1' ' CE1' ' B' ' 17' ' ' TYR . 1.3 m-30 -67.41 -46.67 72.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 114.736 -1.12 . . . . 1.3200000000000001 108.745 178.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.84 -50.27 69.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.646 -1.161 . . . . 1.9399999999999999 111.153 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' B' ' 47' ' ' TYR . 97.3 t -60.74 -51.66 70.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 114.594 -1.184 . . . . 1.1399999999999999 111.534 -179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.81 69.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.096 -0.502 . . . . 0.71999999999999997 111.901 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.94 -37.34 87.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 111.428 0.159 . . . . 1.8899999999999999 111.428 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -60.06 -39.15 85.0 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.474 0.654 . . . . 1.46 109.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.92 -17.15 38.7 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.715 -1.129 . . . . 0.67000000000000004 111.871 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.51 -57.14 0.45 Allowed Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 111.463 -0.655 . . . . 1.21 111.463 -179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -62.19 -159.07 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 116.11 1.893 . . . . 0.71999999999999997 116.11 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 94.7 p -116.39 -169.88 1.7 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 114.243 -1.344 . . . . 1.1000000000000001 112.495 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.512 ' CE1' ' CD1' ' B' ' 7' ' ' TYR . 0.4 OUTLIER -75.89 -26.83 57.39 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 109.908 -0.404 . . . . 1.49 109.908 -179.711 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.693 ' HB2' ' H73' ' D' ' 6' ' ' ' DT' . 10.1 tp60 -55.65 -49.02 74.01 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.505 -0.77 . . . . 1.4299999999999999 112.228 -178.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.506 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.0 OUTLIER -76.34 -38.13 56.33 Favored 'General case' 0 C--N 1.318 -0.796 0 C-N-CA 120.603 -0.439 . . . . 0.78000000000000003 110.893 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.612 HG11 HD22 ' B' ' 6' ' ' LEU . 69.8 t -59.93 -47.95 89.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.933 -0.576 . . . . 1.0800000000000001 110.016 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -67.02 -42.28 85.19 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.803 -0.635 . . . . 1.1200000000000001 109.812 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' HE21 ' B' ' 18' ' ' GLN . 31.8 mtm-85 -57.09 -36.7 70.91 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 110.495 -0.187 . . . . 1.8799999999999999 110.495 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.576 HG21 ' HA ' ' B' ' 35' ' ' ARG . 99.1 t -74.93 -45.15 43.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.849 -0.426 . . . . 1.3899999999999999 109.849 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 11.8 t -56.89 -42.9 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 121.313 0.577 . . . . 1.3100000000000001 110.606 178.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -84.96 10.99 10.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.674 -0.693 . . . . 2.1899999999999999 111.43 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 47.84 41.19 13.99 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 124.331 1.019 . . . . 3.2999999999999998 110.972 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.27 177.23 8.58 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.581 -0.736 . . . . 3.0800000000000001 112.035 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 m -97.78 -176.63 3.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.495 -0.775 . . . . 3.25 110.74 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 63.79 31.54 14.09 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.88 -0.6 . . . . 1.75 110.968 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 23' ' ' VAL . 15.5 t -125.44 122.83 63.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 C-N-CA 120.881 -0.328 . . . . 1.3500000000000001 111.351 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.421 ' HB3' ' OG1' ' B' ' 34' ' ' THR . 47.0 t -66.08 152.1 45.44 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.441 0.639 . . . . 1.5800000000000001 111.082 178.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -61.29 -42.21 98.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 1.27 109.442 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 tppt? -63.22 -33.65 75.95 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.425 -0.807 . . . . 2.2000000000000002 110.627 178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.421 ' OG1' ' HB3' ' B' ' 31' ' ' SER . 47.5 m -68.69 -48.23 64.43 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.18 -0.464 . . . . 1.05 111.084 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.576 ' HA ' HG21 ' B' ' 23' ' ' VAL . 15.7 ptp180 -64.63 -33.42 75.88 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 120.639 0.257 . . . . 1.54 111.454 -179.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -63.88 -42.78 97.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.973 0.416 . . . . 1.97 110.9 -179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -58.56 -57.98 10.56 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.904 -0.589 . . . . 2.5 112.395 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 18.3 m -61.33 -34.75 62.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.599 0.592 . . . . 1.3799999999999999 112.599 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 28.8 mt-10 -63.49 -31.31 72.44 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.981 0.419 . . . . 2.0699999999999998 110.348 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -61.2 -56.18 23.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.729 -0.669 . . . . 0.91000000000000003 110.031 178.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.24 83.44 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.72999999999999998 110.248 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -54.4 -51.37 65.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.651 -0.704 . . . . 1.3999999999999999 112.349 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.84 -36.51 28.22 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.987 0.366 . . . . 1.03 111.987 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 2.0 tp10 -66.1 -43.21 87.9 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.072 0.397 . . . . 2.1000000000000001 112.072 -179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -88.48 -9.34 52.77 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.217 0.451 . . . . 0.83999999999999997 112.217 -178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.3 t30 63.89 66.59 0.65 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.594 0.711 . . . . 1.5600000000000001 110.422 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.546 ' HB2' HG21 ' B' ' 9' ' ' VAL . 14.3 t80 -81.35 135.03 35.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.565 -0.743 . . . . 0.88 111.747 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' B' ' 3' ' ' PRO . 35.2 mm -117.94 126.99 26.9 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 108.441 -0.948 . . . . 1.6000000000000001 108.441 177.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.497 ' HA ' ' OH ' ' B' ' 47' ' ' TYR . 49.9 Cg_exo -55.26 -19.83 22.87 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 123.238 2.625 . . . . 1.45 113.041 -178.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.429 ' H ' HG22 ' B' ' 48' ' ' ILE . 51.7 t-20 59.72 84.31 0.12 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.619 -0.719 . . . . 1.0900000000000001 110.044 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.61 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 0.0 OUTLIER -52.41 -30.89 31.59 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.951 -0.568 . . . . 3.3900000000000001 111.344 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 50.8 m -71.74 -54.31 10.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 112.623 0.601 . . . . 0.82999999999999996 112.623 -179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -46.99 76.12 Favored 'General case' 0 CA--C 1.511 -0.54 0 N-CA-C 109.949 -0.389 . . . . 0.63 109.949 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -44.27 88.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.501 -0.772 . . . . 1.3300000000000001 111.276 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.61 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.5 -37.47 80.12 Favored 'General case' 0 C--N 1.334 -0.092 0 O-C-N 121.69 -0.631 . . . . 3.0299999999999998 110.006 179.169 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.673 HD21 " O4'" ' D' ' 12' ' ' ' DG' . 0.7 OUTLIER -66.81 -32.79 74.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.639 -0.71 . . . . 1.21 109.778 179.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.42 13.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.366 -0.834 . . . . 0.98999999999999999 113.092 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 94.08 28.1 11.35 Favored Glycine 0 CA--C 1.506 -0.483 0 C-N-CA 120.86 -0.685 . . . . 2.0899999999999999 113.668 178.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 mmtt -125.57 21.35 7.8 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.072 -0.714 . . . . 5.9199999999999999 109.072 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 -65.63 126.53 28.67 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.62 -0.718 . . . . 4.8300000000000001 110.128 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 20.4 m -146.91 53.82 1.09 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.34 -0.845 . . . . 6.0899999999999999 110.092 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 32.4 tp . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.677 -0.692 . . . . 7.79 109.649 -179.904 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.5 -1.465 0 C3'-C2'-C1' 98.929 -2.693 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.441 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.053 0 C3'-C2'-C1' 99.704 -2.14 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.441 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.619 0.987 0 C3'-C2'-C1' 99.877 -2.016 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.582 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.953 0 C3'-C2'-C1' 99.597 -2.217 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.582 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 C3'-C2'-C1' 99.131 -2.549 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.48 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 O4'-C1'-C2' 103.738 -2.147 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.48 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.144 0 C3'-C2'-C1' 99.567 -2.238 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.411 ' H8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 C3'-C2'-C1' 99.35 -2.393 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.874 0 C3'-C2'-C1' 99.185 -2.511 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.301 0 C3'-C2'-C1' 99.788 -2.08 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.117 0 O4'-C1'-C2' 103.972 -1.935 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.505 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 100.225 -1.768 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.639 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 C3'-C2'-C1' 99.134 -2.547 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.418 ' C6 ' ' C2 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.961 0 C3'-C2'-C1' 99.677 -2.159 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.713 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.806 0 C3'-C2'-C1' 99.361 -2.385 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.713 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 C3'-C2'-C1' 99.677 -2.16 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.808 0 C3'-C2'-C1' 99.47 -2.307 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.576 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.81 -2.064 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.576 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.943 0 C3'-C2'-C1' 99.138 -2.544 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.597 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 C3'-C2'-C1' 99.49 -2.293 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 100.074 -1.876 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.829 0 C3'-C2'-C1' 99.403 -2.355 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 99.253 -2.462 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 N19-C1'-C2' 116.261 1.288 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.741 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.796 0 C3'-C2'-C1' 99.058 -2.601 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.741 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C4'-C3'-C2' 101.881 -1.319 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.581 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 100.485 -1.582 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.581 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.821 0 C3'-C2'-C1' 105.141 1.743 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.514 ' N7 ' ' HG2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.693 ' H73' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 105.474 1.982 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.613 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.041 0 C3'-C2'-C1' 100.645 -1.468 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.613 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.866 0 O3'-P-O5' 102.746 -0.66 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.501 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.407 -0.968 0 N19-C1'-C2' 116.352 1.345 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.657 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.635 0 C4'-C3'-C2' 101.778 -1.422 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.657 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C3'-C2'-C1' 102.048 -0.465 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.673 " O4'" HD21 ' B' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.526 0.772 0 C3'-C2'-C1' 105.265 1.832 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.67 " H2'" ' H71' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 105.202 1.787 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.67 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 O4'-C4'-C3' 106.339 0.739 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.716 0 C3'-C2'-C1' 101.396 -0.931 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.408 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.598 -0.728 0 C3'-C2'-C1' 101.239 -1.043 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.408 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 101.673 -0.734 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C4'-C3'-C2' 104.093 0.893 . . . . 1.5600000000000001 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.529 " H2'" ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.849 0 C3'-C2'-C1' 101.011 -1.206 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.529 ' H71' " H2'" ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.782 0 C4'-C3'-C2' 104.364 1.164 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.527 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 C3'-C2'-C1' 100.407 -1.638 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.512 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.641 0 N19-C1'-C2' 115.377 0.736 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tpt . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 110.643 -0.132 . . . . 5.7999999999999998 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HD3' ' CB ' ' A' ' 46' ' ' ASN . 47.4 mtpt -132.12 144.91 55.11 Favored Pre-proline 0 N--CA 1.468 0.429 0 N-CA-C 110.32 -0.252 . . . . 5.3499999999999996 110.32 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -70.33 61.12 2.03 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.488 2.125 . . . . 2.4300000000000002 113.271 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 1.5 t -117.64 134.84 59.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.676 -0.861 . . . . 1.03 108.676 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.7 p -109.93 173.41 6.34 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.375 0.607 . . . . 0.76000000000000001 110.207 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.548 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.2 pp -64.43 -19.7 65.69 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.63 -0.714 . . . . 0.98999999999999999 111.522 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -72.47 -36.81 68.55 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.172 0.51 . . . . 1.51 110.695 -179.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -72.54 -53.7 11.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.404 -0.816 . . . . 1.6699999999999999 110.731 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.44 -47.54 26.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.054 -0.976 . . . . 0.70999999999999996 110.074 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.58 ' HB1' ' O ' ' A' ' 16' ' ' SER . . . -64.69 -56.65 12.39 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 114.593 -1.185 . . . . 0.68000000000000005 111.849 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -67.43 -10.81 54.91 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 111.971 0.36 . . . . 2.3999999999999999 111.971 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -94.26 -42.32 9.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 103.614 -2.735 . . . . 1.47 103.614 -176.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.54 -15.93 63.92 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 112.175 -2.284 . . . . 0.77000000000000002 110.139 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.66 -68.35 0.28 Allowed Glycine 0 N--CA 1.431 -1.647 0 N-CA-C 110.9 -0.88 . . . . 1.3700000000000001 110.9 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 33.7 m -43.46 172.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 N-CA-C 117.49 2.404 . . . . 0.77000000000000002 117.49 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.58 ' O ' ' HB1' ' A' ' 10' ' ' ALA . 59.7 p -76.81 -177.14 4.18 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 113.778 -1.555 . . . . 1.3300000000000001 108.747 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.548 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 30.7 p90 -91.4 14.85 13.52 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 119.576 -0.85 . . . . 1.3200000000000001 111.076 -176.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.478 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 6.3 tp-100 -101.53 -33.71 9.83 Favored 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 120.493 -0.483 . . . . 1.4399999999999999 110.501 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -41.37 84.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.726 -0.67 . . . . 0.77000000000000002 110.746 -179.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.421 HG12 HG13 ' A' ' 38' ' ' VAL . 18.9 m -73.27 -43.19 57.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 120.919 -0.313 . . . . 1.3799999999999999 110.79 178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.1 t -58.58 -35.37 72.29 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.995 0.369 . . . . 1.0800000000000001 111.995 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -28.17 69.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.741 0.305 . . . . 2.5499999999999998 111.255 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.3 t -83.87 -36.55 12.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.641 -0.503 . . . . 1.6299999999999999 109.641 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.38 -29.02 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 1.3799999999999999 110.632 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -95.55 -2.77 47.8 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.162 -0.681 . . . . 1.6100000000000001 109.162 178.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 54.55 48.46 20.41 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.301 -1.318 . . . . 3.7000000000000002 111.044 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.35 130.22 36.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.127 -0.488 . . . . 2.1000000000000001 110.083 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.0 m -83.08 68.13 9.42 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.038 0.447 . . . . 1.98 111.472 -178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.63 45.77 0.86 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.419 0.628 . . . . 1.3799999999999999 109.532 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -145.86 142.62 21.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 114.537 -1.21 . . . . 1.1100000000000001 109.341 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.9 m -59.88 143.93 50.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 1.3200000000000001 109.743 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.45 -48.52 65.77 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.939 0.496 . . . . 1.1299999999999999 112.264 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -59.42 -44.46 92.86 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.114 -0.948 . . . . 1.75 112.204 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 38' ' ' VAL . 1.0 OUTLIER -69.36 -36.49 76.9 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 120.772 -0.371 . . . . 0.98999999999999999 110.49 -179.526 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.433 ' HE ' ' HG3' ' A' ' 36' ' ' GLU . 27.6 ttp180 -56.51 -51.91 66.74 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.309 -0.86 . . . . 3.3399999999999999 110.016 178.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.433 ' HG3' ' HE ' ' A' ' 35' ' ' ARG . 37.7 mt-10 -62.75 -42.97 99.93 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.666 -0.697 . . . . 1.76 111.093 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.9 ttmt -54.41 -43.73 71.74 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 121.132 0.491 . . . . 1.45 109.879 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 34' ' ' THR . 35.4 t -59.55 -51.08 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 114.863 -1.062 . . . . 1.45 110.941 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -61.09 -42.18 98.03 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.903 -0.589 . . . . 1.8700000000000001 110.968 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.26 -45.68 75.95 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.805 0.336 . . . . 0.88 111.11 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.46 -37.28 86.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.891 0.377 . . . . 0.70999999999999996 110.689 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ptp -71.51 -34.33 70.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 116.279 -0.418 . . . . 1.47 111.373 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.27 -38.2 60.57 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.752 -0.379 . . . . 0.93000000000000005 111.315 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.66 -48.69 80.66 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.967 -0.56 . . . . 1.72 110.769 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 85.0 mt -81.45 -9.65 59.67 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.872 -0.604 . . . . 0.98999999999999999 111.251 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.451 ' CB ' ' HD3' ' A' ' 2' ' ' LYS . 0.7 OUTLIER 60.92 61.74 1.58 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.815 0.817 . . . . 2.2000000000000002 110.3 -178.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -89.85 139.8 30.23 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.569 -1.196 . . . . 1.23 110.316 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.4 tt -130.39 112.21 16.7 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.294 -0.866 . . . . 1.8799999999999999 109.34 178.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -59.62 114.27 1.98 Allowed 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 121.963 1.775 . . . . 0.83999999999999997 112.232 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.532 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 32.1 t30 -72.49 115.8 12.19 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 115.797 -0.638 . . . . 1.1000000000000001 110.258 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.46 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 39.9 ttt180 -73.47 -20.03 60.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.956 -0.566 . . . . 4.7199999999999998 112.411 -177.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.7 m -65.06 -36.3 83.89 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.571 -0.706 . . . . 0.77000000000000002 109.872 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.592 ' CA ' HD11 ' B' ' 56' ' ' LEU . . . -81.1 -21.27 40.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.66000000000000003 110.383 178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 93.8 mt-30 -73.88 -29.74 62.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.955 -0.566 . . . . 1.46 109.957 -179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.59 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 44.7 mt-30 -89.11 -19.07 26.01 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.238 -0.653 . . . . 1.45 109.238 -177.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.778 HD21 ' C2 ' ' C' ' 11' ' ' ' DG' . 9.2 tp -68.17 -32.16 72.22 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 114.643 -1.162 . . . . 0.78000000000000003 109.848 -178.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.36 14.52 0.57 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.267 -0.424 . . . . 1.0800000000000001 111.769 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.08 51.24 1.79 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.994 -0.622 . . . . 1.6599999999999999 113.245 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 87.2 mttt -141.18 15.04 2.24 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.582 -0.155 . . . . 4.79 110.582 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.56 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 15.4 mp0 -36.11 115.69 0.35 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.015 1.117 . . . . 2.3399999999999999 114.015 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -131.58 33.0 4.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.76 -0.654 . . . . 3.8599999999999999 109.705 178.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.059 -0.972 . . . . 6.96 109.949 -179.005 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.166 -0.309 . . . . 6.9199999999999999 110.166 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.427 ' HB3' ' HD3' ' B' ' 3' ' ' PRO . 11.3 tptm -168.28 -50.41 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.882 -0.58 . . . . 6.4199999999999999 111.957 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.427 ' HD3' ' HB3' ' B' ' 2' ' ' LYS . 44.9 Cg_exo -56.62 100.57 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.132 0 C-N-CA 122.079 1.853 . . . . 2.1000000000000001 112.414 179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.568 HG22 ' HA ' ' B' ' 47' ' ' TYR . 15.2 m -84.77 158.13 3.49 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.281 -0.418 . . . . 1.4299999999999999 109.945 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.617 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 50.4 p -72.61 163.0 28.75 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.718 0.294 . . . . 0.81000000000000005 110.617 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' B' ' 6' ' ' LEU . 5.8 mt -74.44 -20.89 59.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.61 -1.256 . . . . 0.60999999999999999 107.61 177.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -66.72 -43.59 83.85 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 114.701 -1.136 . . . . 1.3200000000000001 108.533 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -53.5 -48.81 68.63 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.144 -0.935 . . . . 1.9399999999999999 110.067 177.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -66.21 -36.76 78.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 114.724 -1.125 . . . . 1.1399999999999999 111.121 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.21 -54.54 42.04 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.54 -0.755 . . . . 0.71999999999999997 110.399 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -56.22 -51.55 67.68 Favored 'General case' 0 C--O 1.231 0.13 0 O-C-N 123.8 0.688 . . . . 1.8899999999999999 111.395 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -57.98 -41.88 83.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.928 -0.578 . . . . 1.46 111.773 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.538 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -75.63 -22.69 56.6 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 113.89 1.07 . . . . 0.67000000000000004 113.89 -177.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.98 41.86 13.48 Favored Glycine 0 N--CA 1.443 -0.888 0 C-N-CA 119.528 -1.32 . . . . 1.21 111.467 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 4.3 m -144.47 171.36 6.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 N-CA-C 110.051 -0.351 . . . . 0.71999999999999997 110.051 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 20' ' ' VAL . 79.4 p -85.48 157.68 20.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.017 0.436 . . . . 1.1000000000000001 110.237 179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -53.49 -42.89 67.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.534 -0.757 . . . . 1.49 111.329 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.696 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 14.5 tp60 -55.78 -50.38 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.387 -0.824 . . . . 1.4299999999999999 110.975 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 2.1 m -64.52 -34.15 77.56 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.526 -0.761 . . . . 0.78000000000000003 111.229 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 16' ' ' SER . 93.9 t -58.65 -45.36 90.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.611 -0.722 . . . . 1.0800000000000001 110.509 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -40.67 94.71 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.0 -0.546 . . . . 1.1200000000000001 111.254 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.402 ' CZ ' ' H73' ' D' ' 4' ' ' ' DT' . 72.7 mtt180 -54.46 -44.63 72.71 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 123.234 0.334 . . . . 1.8799999999999999 110.348 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.501 HG22 HG13 ' B' ' 30' ' ' VAL . 51.9 t -62.37 -44.58 99.36 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.095 0 N-CA-C 109.91 -0.404 . . . . 1.3899999999999999 109.91 178.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 1.4 t -60.07 -46.3 94.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-O 121.463 0.649 . . . . 1.3100000000000001 109.838 178.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -68.68 -10.15 54.49 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.968 -1.014 . . . . 2.1899999999999999 110.137 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.472 ' HG3' ' N ' ' B' ' 27' ' ' ALA . 0.0 OUTLIER 75.8 -41.4 0.43 Allowed 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.209 1.403 . . . . 3.2999999999999998 111.859 178.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.472 ' N ' ' HG3' ' B' ' 26' ' ' GLN . . . -108.37 -156.43 0.58 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.233 1.197 . . . . 3.0800000000000001 114.233 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.408 ' H ' ' HB1' ' B' ' 27' ' ' ALA . 8.5 m 55.42 72.0 0.51 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.186 1.18 . . . . 3.25 114.186 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 53.0 m80 60.66 64.99 1.09 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.384 1.253 . . . . 1.75 114.384 175.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.501 HG13 HG22 ' B' ' 23' ' ' VAL . 32.9 t -109.97 91.02 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.292 -0.867 . . . . 1.3500000000000001 111.581 178.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.542 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 58.6 m -52.66 137.25 31.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.707 0.289 . . . . 1.5800000000000001 110.423 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.56 -42.59 83.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.095 -0.502 . . . . 1.27 110.482 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -64.95 -29.28 70.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.544 -0.753 . . . . 2.2000000000000002 111.314 177.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.542 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 52.5 m -73.63 -43.43 59.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.992 -0.549 . . . . 1.05 111.062 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 4.7 ptp180 -66.64 -32.28 73.49 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.606 -0.438 . . . . 1.54 110.487 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -67.31 -39.77 85.93 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-O 121.193 0.521 . . . . 1.97 110.529 179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -59.05 -56.21 25.16 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.331 -0.849 . . . . 2.5 110.418 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.538 ' HA ' ' HB2' ' B' ' 13' ' ' ALA . 5.0 m -68.3 -25.75 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 N-CA-C 112.952 0.723 . . . . 1.3799999999999999 112.952 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 30.8 mt-10 -66.94 -36.14 81.57 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 120.325 -0.55 . . . . 2.0699999999999998 110.052 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.41 -42.67 99.61 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.418 -0.586 . . . . 0.91000000000000003 109.418 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' B' ' 45' ' ' LEU . . . -67.47 -43.03 82.02 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.425 -0.807 . . . . 0.72999999999999998 110.486 179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.6 ttm -57.29 -50.22 73.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.742 -0.663 . . . . 1.3999999999999999 111.608 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.43 -40.83 70.17 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.59 0.589 . . . . 1.03 112.59 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -80.53 -17.54 51.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.637 0.977 . . . . 2.1000000000000001 113.637 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 41' ' ' ALA . 37.4 mt -108.58 -23.11 11.97 Favored 'General case' 0 N--CA 1.446 -0.654 0 O-C-N 121.451 -0.781 . . . . 0.83999999999999997 110.775 -179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . 0.415 HD22 ' HE2' ' B' ' 2' ' ' LYS . 12.4 t-20 68.18 75.42 0.27 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 122.22 1.009 . . . . 1.5600000000000001 112.233 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.568 ' HA ' HG22 ' B' ' 4' ' ' VAL . 11.2 t80 -86.97 128.88 35.07 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 114.72 -1.127 . . . . 0.88 110.349 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 15.6 mm -128.16 124.41 23.02 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 108.332 -0.988 . . . . 1.6000000000000001 108.332 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.445 ' HB3' ' NE2' ' B' ' 54' ' ' GLN . 36.8 Cg_exo -54.91 127.12 24.94 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 122.215 1.944 . . . . 1.45 112.409 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.586 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 50.3 t-20 -76.28 105.07 7.12 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.907 -0.775 . . . . 1.0900000000000001 108.907 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 4.1 tpp180 -53.83 -40.25 66.27 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 123.368 0.418 . . . . 3.3900000000000001 111.156 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.444 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 55.1 m -68.3 -41.22 81.24 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 116.382 -0.372 . . . . 0.82999999999999996 111.379 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.586 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -67.51 -48.33 67.37 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.969 -0.382 . . . . 0.63 109.969 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.445 ' NE2' ' HB3' ' B' ' 49' ' ' PRO . 94.4 mt-30 -53.97 -48.86 69.9 Favored 'General case' 0 N--CA 1.46 0.07 0 CA-C-O 121.428 0.633 . . . . 1.3300000000000001 110.944 178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -61.69 -34.44 75.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.527 -0.76 . . . . 3.0299999999999998 110.758 -179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.592 HD11 ' CA ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -79.92 -37.89 33.63 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.39 -0.823 . . . . 1.21 111.552 -179.282 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.61 -8.25 52.87 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.72 0.637 . . . . 0.98999999999999999 112.72 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . 0.529 ' O ' ' HG3' ' B' ' 59' ' ' LYS . . . 99.36 104.7 2.56 Favored Glycine 0 N--CA 1.431 -1.678 0 N-CA-C 109.099 -1.601 . . . . 2.0899999999999999 109.099 -176.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.529 ' HG3' ' O ' ' B' ' 58' ' ' GLY . 11.3 mtpp 171.95 -38.1 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.791 1.236 . . . . 5.9199999999999999 109.664 -178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 14.1 mt-30 -149.33 39.36 0.82 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.145 -1.057 . . . . 4.8300000000000001 108.145 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -69.63 100.26 1.43 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.761 -0.654 . . . . 6.0899999999999999 111.152 -179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.527 -0.749 . . . . 7.79 111.348 -179.835 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.051 0 C3'-C2'-C1' 99.546 -2.253 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.542 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.058 0 C3'-C2'-C1' 99.196 -2.503 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.542 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.543 0 O4'-C1'-C2' 103.863 -2.033 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.429 ' H8 ' H2'' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.466 -2.31 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 98.574 -2.947 . . . . 1.1799999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.534 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 C3'-C2'-C1' 100.036 -1.903 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.534 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.868 0 C3'-C2'-C1' 99.499 -2.287 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.078 0 C3'-C2'-C1' 99.225 -2.482 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.725 0 C3'-C2'-C1' 99.453 -2.32 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.564 0 C3'-C2'-C1' 99.552 -2.248 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.716 -2.132 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.778 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 C3'-C2'-C1' 100.073 -1.877 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.548 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 98.873 -2.733 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.519 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.842 0 O4'-C1'-C2' 103.797 -2.094 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.519 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.894 0 C3'-C2'-C1' 99.42 -2.343 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.459 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.983 0 O4'-C1'-C2' 103.996 -1.912 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . 0.417 H2'' ' C5 ' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.721 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.6299999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.453 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.201 0 C3'-C2'-C1' 99.806 -2.067 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.566 " H1'" ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.566 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.948 0 C3'-C2'-C1' 99.303 -2.426 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.513 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.109 0 C3'-C2'-C1' 99.927 -1.981 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.513 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.404 ' C8 ' " H1'" ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.92 0 C3'-C2'-C1' 99.241 -2.47 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.923 0 C3'-C2'-C1' 100.245 -1.753 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.692 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.951 0 C3'-C2'-C1' 100.153 -1.819 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.692 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.737 0 O4'-C1'-C2' 107.206 1.006 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.498 " H2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.806 0 C3'-C2'-C1' 105.619 2.085 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.498 ' C6 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C4'-C3'-C2' 104.374 1.174 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.726 1.447 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.709 " H1'" " O4'" ' D' ' 7' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.756 0 C3'-C2'-C1' 105.135 1.739 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.709 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.866 0 C4'-C3'-C2' 104.554 1.354 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.524 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.822 0 C3'-C2'-C1' 105.572 2.052 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.524 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.947 0 C3'-C2'-C1' 100.31 -1.707 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 C4'-C3'-O3' 113.998 1.681 . . . . 1.4099999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.44 1.24 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.558 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.53 1.177 0 C3'-C2'-C1' 104.752 1.466 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.546 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.827 0 C3'-C2'-C1' 104.93 1.593 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.78 0 N19-C1'-C2' 116.14 1.212 . . . . 0.77000000000000002 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.858 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 106.669 2.835 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.858 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.628 1.716 0 C3'-C2'-C1' 101.325 -0.982 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.42 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.614 0.583 0 N19-C1'-C2' 115.585 0.866 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.417 ' H8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 106.855 0.687 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.411 ' C4 ' ' C5 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 N19-C1'-C2' 115.36 0.725 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.639 H2'' ' H71' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.718 0 O4'-C1'-C2' 104.721 -1.254 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.639 ' H71' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 N19-C1'-C2' 115.205 0.628 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 O4'-C1'-C2' 105.372 -0.662 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.1 ttp . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.915 0.388 . . . . 5.7999999999999998 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.484 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 34.7 mttm -85.53 136.6 37.11 Favored Pre-proline 0 N--CA 1.451 -0.421 0 CA-C-N 116.072 -0.513 . . . . 5.3499999999999996 111.04 -179.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 5.8 Cg_exo -75.94 100.18 1.35 Allowed 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.838 2.359 . . . . 2.4300000000000002 111.606 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.405 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 2.1 t -82.37 123.91 38.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.734 -0.666 . . . . 1.03 110.02 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 35.0 p -106.23 170.86 7.67 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.815 -0.809 . . . . 0.76000000000000001 108.815 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.511 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -59.06 -22.44 60.76 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.875 -0.73 . . . . 0.98999999999999999 112.311 179.585 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -68.29 -35.93 78.59 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.689 -0.856 . . . . 1.51 108.689 179.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -68.05 -45.4 74.01 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.512 -0.767 . . . . 1.6699999999999999 110.865 -179.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.75 -38.72 83.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.352 -0.84 . . . . 0.70999999999999996 108.89 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.06 -56.67 19.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.47 -0.786 . . . . 0.68000000000000005 110.531 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -56.4 -43.72 79.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.021 -0.536 . . . . 2.3999999999999999 111.926 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -65.57 -42.2 92.04 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.232 -0.44 . . . . 1.47 111.356 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -79.56 -16.07 56.58 Favored 'General case' 0 C--O 1.238 0.48 0 N-CA-C 112.96 0.726 . . . . 0.77000000000000002 112.96 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.8 39.41 13.84 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.169 -1.015 . . . . 1.3700000000000001 110.756 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.443 HG22 ' HB3' ' A' ' 13' ' ' ALA . 19.5 m -143.51 -169.85 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 109.956 -0.386 . . . . 0.77000000000000002 109.956 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 63.2 m -100.15 162.22 13.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.739 0.304 . . . . 1.3300000000000001 110.468 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.486 ' HB2' HD13 ' A' ' 6' ' ' LEU . 7.1 p90 -55.43 -36.35 66.41 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 112.719 0.637 . . . . 1.3200000000000001 112.719 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -71.77 -29.66 64.72 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.844 -0.343 . . . . 1.4399999999999999 111.378 -179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.2 m -59.85 -45.82 91.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.529 -0.305 . . . . 0.77000000000000002 111.467 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.451 HG12 ' HB ' ' A' ' 38' ' ' VAL . 13.1 m -65.97 -50.4 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.688 0 C-N-CA 120.678 -0.409 . . . . 1.3799999999999999 110.181 178.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -52.11 -38.32 56.97 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 113.258 0.836 . . . . 1.0800000000000001 113.258 178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.408 ' CZ ' ' H73' ' C' ' 4' ' ' ' DT' . 45.2 mtm-85 -58.5 -36.92 74.54 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.884 -0.327 . . . . 2.5499999999999998 111.233 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.522 HG21 ' HA ' ' A' ' 35' ' ' ARG . 44.7 t -84.9 -29.29 6.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 1.6299999999999999 109.984 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.4 HG12 ' ND2' ' A' ' 25' ' ' ASN . 0.5 OUTLIER -70.01 -17.77 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.64 0.733 . . . . 1.3799999999999999 110.706 179.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 26.0 m-80 -107.62 -20.96 13.06 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.077 -0.965 . . . . 1.6100000000000001 110.563 -177.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.598 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 3.4 mp0 83.56 54.96 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 O-C-N 124.066 0.854 . . . . 3.7000000000000002 111.034 177.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.05 135.13 40.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.272 -0.422 . . . . 2.1000000000000001 110.834 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.1 m -81.88 65.29 6.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.217 0.532 . . . . 1.98 111.305 -179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 49.72 0.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.517 -0.549 . . . . 1.3799999999999999 109.517 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.3 t -150.61 146.56 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 115.956 -0.566 . . . . 1.1100000000000001 109.905 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 m -78.82 159.73 27.7 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.733 0.301 . . . . 1.3200000000000001 110.637 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' ARG . . . -57.02 -51.0 70.99 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.302 0.482 . . . . 1.1299999999999999 112.302 -179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -54.31 -61.32 2.38 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 123.908 0.755 . . . . 1.75 110.889 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -34.77 63.03 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 123.537 0.523 . . . . 0.98999999999999999 111.327 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 36.3 ttp180 -57.02 -58.32 8.7 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.555 -0.535 . . . . 3.3399999999999999 109.555 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -69.39 -32.35 71.32 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.069 -0.514 . . . . 1.76 111.727 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -56.67 -54.95 40.16 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 120.543 0.211 . . . . 1.45 110.736 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.451 ' HB ' HG12 ' A' ' 20' ' ' VAL . 8.5 m -66.23 -32.12 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 1.45 111.971 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 60.2 mt-10 -60.76 -54.14 48.79 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.152 0.501 . . . . 1.8700000000000001 110.72 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.48 99.55 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.461 -0.791 . . . . 0.88 110.567 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.39 -51.69 67.74 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.267 -0.424 . . . . 0.70999999999999996 112.078 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 19.3 ptp -61.33 -33.63 73.92 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.377 0.51 . . . . 1.47 112.377 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.67 -37.76 41.06 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.791 -0.568 . . . . 0.93000000000000005 110.865 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.28 -46.27 89.0 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.73 0.3 . . . . 1.72 110.86 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.0 mt -86.65 -9.19 56.55 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.765 -0.198 . . . . 0.98999999999999999 111.398 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.34 65.54 0.96 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.519 0.676 . . . . 2.2000000000000002 110.246 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 7.6 t80 -93.24 136.12 33.81 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.119 -0.946 . . . . 1.23 112.441 -179.223 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.6 pt -113.38 125.71 29.24 Favored Pre-proline 0 CA--C 1.53 0.197 0 N-CA-C 109.324 -0.621 . . . . 1.8799999999999999 109.324 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -73.03 86.84 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 122.27 1.98 . . . . 0.83999999999999997 113.684 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -39.97 117.03 0.71 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.331 0.653 . . . . 1.1000000000000001 110.8 177.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -83.1 -21.72 33.6 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.958 0.725 . . . . 4.7199999999999998 112.958 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -40.54 95.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.456 0.646 . . . . 0.77000000000000002 109.678 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -49.85 65.38 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.249 -1.342 . . . . 0.66000000000000003 109.879 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.417 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 98.9 mt-30 -49.33 -39.79 32.81 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 114.866 -1.061 . . . . 1.46 112.441 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -83.34 -46.74 12.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.392 0.615 . . . . 1.45 110.054 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.69 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 24.7 tp -48.51 -40.64 27.46 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.643 -1.162 . . . . 0.78000000000000003 111.703 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.62 10.03 1.95 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.502 0.556 . . . . 1.0800000000000001 112.502 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.66 -100.19 0.17 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.947 -0.644 . . . . 1.6599999999999999 112.31 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -117.67 136.03 53.6 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.142 -0.688 . . . . 4.79 109.142 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -104.4 9.73 35.61 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 116.492 -0.322 . . . . 2.3399999999999999 111.111 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.552 ' OG ' ' HA ' ' B' ' 1' ' ' MET . 18.5 m -104.73 70.28 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.318 0.58 . . . . 3.8599999999999999 110.14 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 pt? . . . . . 0 C--O 1.246 0.9 0 CA-C-N 115.386 -0.825 . . . . 6.96 109.725 -179.801 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.552 ' HA ' ' OG ' ' A' ' 61' ' ' SER . 39.6 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.735 0.302 . . . . 6.9199999999999999 110.711 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -109.51 102.04 48.25 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 115.959 -0.564 . . . . 6.4199999999999999 109.923 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -86.87 -158.26 0.08 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.967 2.445 . . . . 2.1000000000000001 112.951 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.22 149.33 4.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 115.308 -0.86 . . . . 1.4299999999999999 109.264 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.505 ' O ' HG23 ' B' ' 9' ' ' VAL . 74.4 p -92.75 165.03 13.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.769 0.318 . . . . 0.81000000000000005 111.031 -179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.588 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 5.3 mt -68.36 -21.46 64.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.168 -0.679 . . . . 0.60999999999999999 109.168 177.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -62.56 -53.03 60.81 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.148 -0.933 . . . . 1.3200000000000001 109.548 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.47 -43.56 88.98 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.362 -0.835 . . . . 1.9399999999999999 110.999 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 5' ' ' THR . 57.8 t -53.49 -48.54 57.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-N 115.239 -0.891 . . . . 1.1399999999999999 110.762 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.33 -53.25 58.53 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.911 -0.586 . . . . 0.71999999999999997 110.829 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.28 -43.16 67.24 Favored 'General case' 0 C--N 1.344 0.344 0 CA-C-O 121.154 0.502 . . . . 1.8899999999999999 110.743 179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.455 ' CD1' ' HB2' ' B' ' 41' ' ' ALA . 25.9 t80 -59.33 -52.17 66.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.661 -0.699 . . . . 1.46 111.514 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.84 -13.36 59.91 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 114.916 1.45 . . . . 0.67000000000000004 114.916 -177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.66 48.27 7.33 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 119.793 -1.194 . . . . 1.21 111.582 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.493 HG21 ' CG1' ' B' ' 38' ' ' VAL . 3.2 m -147.62 178.63 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.99 -0.374 . . . . 0.71999999999999997 109.99 -179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.5 p -96.65 150.2 20.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.497 0.189 . . . . 1.1000000000000001 111.033 179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -41.79 -53.02 3.83 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.582 0.706 . . . . 1.49 111.066 177.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.617 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 14.7 tp60 -45.11 -47.07 12.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.415 -1.266 . . . . 1.4299999999999999 113.182 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.97 -26.26 61.3 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 120.877 -0.329 . . . . 0.78000000000000003 111.774 -179.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.447 ' CG1' HD22 ' B' ' 6' ' ' LEU . 41.8 t -73.34 -59.55 3.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 N-CA-C 108.599 -0.889 . . . . 1.0800000000000001 108.599 179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.546 ' O ' HG12 ' B' ' 24' ' ' VAL . 28.5 t -51.81 -16.09 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.413 -0.812 . . . . 1.1200000000000001 111.409 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 42.5 mtt180 -72.96 -45.03 60.29 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.893 -0.41 . . . . 1.8799999999999999 109.893 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.09 -25.24 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.099 0.476 . . . . 1.3899999999999999 110.061 -179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.546 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -61.9 -17.51 17.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 115.054 -0.975 . . . . 1.3100000000000001 111.491 179.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -107.4 -30.65 8.55 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.797 -0.816 . . . . 2.1899999999999999 108.797 -178.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.557 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 8.9 pt20 172.12 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 114.884 -1.053 . . . . 3.2999999999999998 108.805 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.557 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . -177.52 -81.03 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.121 -1.066 . . . . 3.0800000000000001 108.121 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.1 m 53.19 93.25 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.605 0.594 . . . . 3.25 112.605 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 77.2 m80 63.54 50.7 2.73 Favored 'General case' 0 C--N 1.357 0.914 0 CA-C-O 120.884 0.373 . . . . 1.75 111.771 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' B' ' 22' ' ' ARG . 58.2 t -130.08 130.87 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 CA-C-N 116.142 -0.481 . . . . 1.3500000000000001 111.475 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.9 m -77.3 149.23 35.37 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.789 -0.641 . . . . 1.5800000000000001 109.417 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.711 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -52.64 -48.88 66.12 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.323 -0.236 . . . . 1.27 111.359 179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.2 tppt? -50.4 -51.64 44.54 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.064 -0.516 . . . . 2.2000000000000002 110.651 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.0 m -52.35 -50.96 61.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.57 0.952 . . . . 1.05 113.57 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 17.8 ptp180 -62.12 -42.92 99.71 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.782 -0.367 . . . . 1.54 111.571 -178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.6 tt0 -63.34 -41.35 98.88 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.047 0.451 . . . . 1.97 110.267 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -51.68 -60.51 3.08 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.101 -0.954 . . . . 2.5 110.862 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.493 ' CG1' HG21 ' B' ' 15' ' ' VAL . 26.0 m -67.54 -23.67 30.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 N-CA-C 113.932 1.086 . . . . 1.3799999999999999 113.932 -178.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.594 ' O ' ' HB2' ' B' ' 42' ' ' MET . 51.0 mt-10 -64.72 -23.78 67.36 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 118.804 0.729 . . . . 2.0699999999999998 111.143 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.18 -53.94 45.39 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.344 -0.389 . . . . 0.91000000000000003 110.007 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.455 ' HB2' ' CD1' ' B' ' 12' ' ' TYR . . . -64.9 -30.77 71.78 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.392 -0.367 . . . . 0.72999999999999998 110.06 179.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.594 ' HB2' ' O ' ' B' ' 39' ' ' GLU . 12.1 mmt -50.15 -62.38 1.61 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.502 -0.772 . . . . 1.3999999999999999 111.853 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.5 -42.78 42.22 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 112.188 0.44 . . . . 1.03 112.188 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -55.16 -53.17 59.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.884 -0.598 . . . . 2.1000000000000001 112.379 -179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.56 -11.72 58.23 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.214 0.45 . . . . 0.83999999999999997 112.214 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.8 t30 62.89 69.07 0.6 Allowed 'General case' 0 C--N 1.341 0.235 0 CA-C-O 121.376 0.608 . . . . 1.5600000000000001 110.815 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.588 ' CZ ' ' HG ' ' B' ' 6' ' ' LEU . 63.2 t80 -80.54 116.02 20.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.108 -0.496 . . . . 0.88 111.383 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -118.0 104.33 48.8 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 108.963 -0.754 . . . . 1.6000000000000001 108.963 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -67.07 85.77 0.32 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.015 2.476 . . . . 1.45 113.968 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 41.6 t-20 -32.58 129.82 0.2 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.687 0.795 . . . . 1.0900000000000001 113.075 178.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' B' ' 62' ' ' LEU . 3.8 tpp180 -63.58 -34.8 78.61 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 115.388 -0.824 . . . . 3.3900000000000001 110.44 -178.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.47 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 85.4 m -64.05 -48.63 75.52 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 120.882 0.372 . . . . 0.82999999999999996 110.03 178.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -46.49 88.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.761 -0.654 . . . . 0.63 109.353 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 10.4 mm-40 -56.54 -55.45 33.72 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 115.664 -0.698 . . . . 1.3300000000000001 111.341 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.798 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 1.3 pt20 -62.88 -30.7 71.72 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 116.147 -0.479 . . . . 3.0299999999999998 112.262 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.679 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -81.53 -24.18 36.79 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.151 -0.477 . . . . 1.21 111.269 -179.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.09 9.07 9.19 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.295 0.48 . . . . 0.98999999999999999 112.295 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.24 -2.44 16.45 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.018 -1.087 . . . . 2.0899999999999999 113.792 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.798 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 58.7 mmtt -96.44 85.61 3.96 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.159 -0.682 . . . . 5.9199999999999999 109.159 179.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -83.74 56.77 3.78 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.233 0.539 . . . . 4.8300000000000001 111.244 -177.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.85 -15.96 23.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.582 -0.736 . . . . 6.0899999999999999 110.469 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' B' ' 62' ' ' LEU . 2.1 mm? . . . . . 0 C--O 1.249 1.026 0 CA-C-O 117.767 -1.111 . . . . 7.79 110.182 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.51 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.582 -2.227 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.51 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.255 0 C3'-C2'-C1' 99.679 -2.158 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C1'-C2' 103.807 -2.084 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.648 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 C3'-C2'-C1' 99.076 -2.589 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.648 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.133 0 C3'-C2'-C1' 99.281 -2.442 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.442 ' C8 ' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.871 0 O4'-C1'-C2' 103.889 -2.01 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.519 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 C3'-C2'-C1' 99.027 -2.624 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.519 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.086 0 C3'-C2'-C1' 99.028 -2.623 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.505 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.823 0 C3'-C2'-C1' 99.652 -2.177 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.419 ' C4 ' ' C4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.964 0 O4'-C1'-C2' 103.932 -1.971 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.564 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 O4'-C1'-C2' 103.797 -2.094 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.564 ' C8 ' H2'' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.946 0 C3'-C2'-C1' 99.994 -1.933 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.495 ' N7 ' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.068 0 C3'-C2'-C1' 99.005 -2.64 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.418 H2'' ' C6 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.135 0 C3'-C2'-C1' 99.85 -2.036 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.418 ' C6 ' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.789 0 C3'-C2'-C1' 99.314 -2.418 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.452 -2.32 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.912 0 C3'-C2'-C1' 99.823 -2.055 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.423 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.519 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.836 0 C3'-C2'-C1' 98.711 -2.85 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.519 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.875 0 C3'-C2'-C1' 99.634 -2.19 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.454 ' C4 ' ' C5 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.045 0 C3'-C2'-C1' 99.583 -2.227 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.459 ' C2 ' ' C5 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.459 ' C5 ' ' C2 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.092 0 C3'-C2'-C1' 99.437 -2.331 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.653 0 O5'-P-OP1 106.798 -0.449 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.456 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 C3'-C2'-C1' 99.594 -2.219 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.734 0 C4'-C3'-C2' 102.619 -0.581 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.584 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.731 -1.406 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.584 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.726 0 O4'-C1'-C2' 105.098 -0.911 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.539 H2'' ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.796 0 C3'-C2'-C1' 101.894 -0.576 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.617 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.424 -0.97 0 N19-C1'-C2' 115.674 0.921 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.407 -1.004 0 C1'-O4'-C4' 106.821 -2.056 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.601 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 105.55 2.036 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.601 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 C3'-C2'-C1' 100.702 -1.427 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.443 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.059 -2.601 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.479 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.55 0 C3'-C2'-C1' 101.952 -0.534 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.69 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.508 -0.893 0 C4'-C3'-C2' 104.648 1.448 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.54 " H2'" ' H71' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.439 -0.642 0 C1'-O4'-C4' 106.843 -2.041 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.54 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 O4'-C1'-C2' 105.157 -0.858 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.64 H2'' " O5'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.525 0.684 0 C3'-C2'-C1' 106.251 2.536 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.64 " O5'" H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 C4'-C3'-C2' 103.934 0.734 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.803 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.441 0.774 0 C3'-C2'-C1' 105.273 1.838 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.803 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.631 1.967 0 C3'-C2'-C1' 104.916 1.583 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.748 0 C3'-C2'-C1' 101.143 -1.112 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.409 -0.858 0 C1'-O4'-C4' 107.321 -1.7 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.572 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 C3'-C2'-C1' 100.205 -1.782 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.572 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.697 0 C5'-C4'-O4' 108.204 -0.748 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 tpt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 120.935 0.398 . . . . 5.7999999999999998 111.194 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 37.7 mmtt -124.17 125.56 25.72 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 116.608 -0.269 . . . . 5.3499999999999996 110.402 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 7.5 Cg_exo -70.06 98.37 0.71 Allowed 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.106 1.871 . . . . 2.4300000000000002 110.666 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.429 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.8 t -72.53 134.1 30.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.946 -0.57 . . . . 1.03 109.987 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -111.08 165.36 11.96 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.87 -0.789 . . . . 0.76000000000000001 108.87 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.607 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.0 pp -55.45 -21.52 16.52 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.785 0.661 . . . . 0.98999999999999999 112.785 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -69.77 -34.16 73.41 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.293 0.568 . . . . 1.51 109.571 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.429 ' HB2' HG12 ' A' ' 4' ' ' VAL . 31.9 m-20 -71.44 -38.0 71.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.386 -0.824 . . . . 1.6699999999999999 109.735 -179.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 t -74.44 -45.49 45.93 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 CA-C-N 115.911 -0.586 . . . . 0.70999999999999996 111.125 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.05 74.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.334 0.588 . . . . 0.68000000000000005 111.098 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.71 -37.94 87.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 2.3999999999999999 110.292 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -69.2 -31.94 70.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.57 -0.741 . . . . 1.47 110.928 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.99 -15.95 37.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.945 -0.57 . . . . 0.77000000000000002 111.956 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.69 41.31 9.9 Favored Glycine 0 C--N 1.328 0.123 0 C-N-CA 120.841 -0.695 . . . . 1.3700000000000001 111.994 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.4 m -146.29 179.69 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 110.015 -0.365 . . . . 0.77000000000000002 110.015 -179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.0 p -79.76 169.59 17.73 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.064 -0.717 . . . . 1.3300000000000001 109.064 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.607 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 52.8 p90 -72.95 4.0 4.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.958 0.355 . . . . 1.3200000000000001 111.958 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -93.61 -30.59 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.928 0.394 . . . . 1.4399999999999999 111.113 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.78 -39.02 92.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.987 -0.551 . . . . 0.77000000000000002 112.046 -178.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.435 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 6.9 p -86.32 -15.34 10.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.808 0.813 . . . . 1.3799999999999999 109.703 -179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -85.92 -30.94 22.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.631 -1.168 . . . . 1.0800000000000001 110.848 -176.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HD3' HG23 ' A' ' 30' ' ' VAL . 3.8 ttt180 -66.3 -34.38 77.86 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.409 -0.814 . . . . 2.5499999999999998 112.57 -177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.607 ' HA ' ' HB2' ' A' ' 27' ' ' ALA . 33.9 m -74.6 -19.41 16.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.898 0.38 . . . . 1.6299999999999999 111.844 -177.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.0 t -76.17 -19.98 15.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 112.096 0.406 . . . . 1.3799999999999999 112.096 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.515 ' HB2' ' NE2' ' A' ' 26' ' ' GLN . 57.4 m-80 -112.13 -61.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.98 0.733 . . . . 1.6100000000000001 112.98 -176.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.515 ' NE2' ' HB2' ' A' ' 25' ' ' ASN . 0.0 OUTLIER -124.52 -46.91 1.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.454 -0.339 . . . . 3.7000000000000002 111.655 -177.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.607 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 77.0 21.19 1.15 Allowed 'General case' 0 C--N 1.322 -0.607 0 O-C-N 124.696 1.248 . . . . 2.1000000000000001 109.256 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.4 m -90.41 140.67 29.5 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.254 -0.884 . . . . 1.98 110.486 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.0 65.69 0.23 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.809 0.693 . . . . 1.3799999999999999 111.046 -179.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.472 HG23 ' HD3' ' A' ' 22' ' ' ARG . 1.5 t -150.6 146.21 16.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 114.708 -1.133 . . . . 1.1100000000000001 109.411 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.426 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 7.0 m -80.75 148.51 30.05 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 110.085 -0.339 . . . . 1.3200000000000001 110.085 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -52.69 -52.54 55.58 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 124.117 0.886 . . . . 1.1299999999999999 111.307 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 13.1 ttpt -55.43 -54.76 39.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.787 -0.642 . . . . 1.75 112.364 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.0 OUTLIER -62.5 -33.51 75.03 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.537 0.199 . . . . 0.98999999999999999 111.537 -179.624 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -52.5 60.53 Favored 'General case' 0 CA--C 1.521 -0.154 0 N-CA-C 109.534 -0.543 . . . . 3.3399999999999999 109.534 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -59.75 -38.77 82.66 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 120.856 0.36 . . . . 1.76 110.712 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -54.3 -55.39 28.78 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.811 -0.811 . . . . 1.45 108.811 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.435 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 34.7 t -56.49 -47.43 81.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 114.287 -1.324 . . . . 1.45 111.492 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -61.23 -43.04 99.53 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.103 0.409 . . . . 1.8700000000000001 112.103 -178.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.23 -40.15 71.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.173 -0.467 . . . . 0.88 111.612 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.81 -39.41 83.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.946 -0.57 . . . . 0.70999999999999996 112.045 -179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 43' ' ' ALA . 8.7 ptp -69.52 -36.89 76.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.915 0.339 . . . . 1.47 111.915 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.417 ' N ' ' HG3' ' A' ' 42' ' ' MET . . . -73.21 -40.79 64.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.849 0.357 . . . . 0.93000000000000005 110.064 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.03 -35.88 67.38 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.487 -0.779 . . . . 1.72 111.564 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.68 -2.64 40.93 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.189 -0.204 . . . . 0.98999999999999999 111.089 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.9 m120 55.46 59.37 3.94 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 123.449 0.468 . . . . 2.2000000000000002 110.406 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -86.71 126.01 34.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.371 -0.377 . . . . 1.23 111.292 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.7 tt -104.86 125.13 34.6 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 108.518 -0.919 . . . . 1.8799999999999999 108.518 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.38 117.68 4.47 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.785 2.323 . . . . 0.83999999999999997 113.689 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 46.4 t-20 -70.81 112.95 7.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.987 -1.006 . . . . 1.1000000000000001 108.568 178.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.464 ' HG3' ' OE1' ' A' ' 54' ' ' GLN . 54.8 ttt180 -85.8 -11.8 52.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.903 -0.59 . . . . 4.7199999999999998 112.363 -177.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.5 m -65.84 -47.49 74.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.577 -0.897 . . . . 0.77000000000000002 108.577 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.28 -14.93 60.98 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.841 -1.527 . . . . 0.66000000000000003 111.4 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.522 ' HG2' ' OP1' ' D' ' 14' ' ' ' DT' . 70.9 mt-30 -73.44 -38.56 65.46 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 122.266 1.032 . . . . 1.46 109.461 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.633 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 62.0 mt-30 -86.15 -45.31 11.48 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.188 -1.369 . . . . 1.45 109.584 -179.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.555 HD23 ' CD2' ' B' ' 56' ' ' LEU . 3.2 tp -54.29 -31.75 54.7 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.896 -1.502 . . . . 0.78000000000000003 113.506 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.73 -62.73 1.47 Allowed 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 118.679 -1.208 . . . . 1.0800000000000001 111.13 -179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -154.33 -56.17 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 117.543 -2.265 . . . . 1.6599999999999999 113.916 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.511 ' HZ2' " C3'" ' D' ' 14' ' ' ' DT' . 0.2 OUTLIER -42.43 -53.38 4.29 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.589 0.589 . . . . 4.79 112.589 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.633 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.8 OUTLIER 64.73 -167.35 0.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.707 -0.679 . . . . 2.3399999999999999 110.191 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.26 -47.84 13.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.571 0.224 . . . . 3.8599999999999999 110.776 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.586 -0.721 . . . . 6.96 110.212 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.895 0.379 . . . . 6.9199999999999999 111.252 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -77.82 140.07 62.65 Favored Pre-proline 0 N--CA 1.45 -0.432 0 CA-C-N 115.997 -0.547 . . . . 6.4199999999999999 111.023 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 154.41 47.26 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.725 2.284 . . . . 2.1000000000000001 112.814 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 14.3 m -128.35 165.68 27.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.243 -0.89 . . . . 1.4299999999999999 109.77 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.7 158.19 18.88 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.879 -0.415 . . . . 0.81000000000000005 109.879 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.489 HD22 ' CG1' ' B' ' 20' ' ' VAL . 12.7 mt -66.98 -21.15 65.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.208 0.527 . . . . 0.60999999999999999 110.019 179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -64.65 -42.23 95.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.367 -0.833 . . . . 1.3200000000000001 110.033 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.14 -45.95 91.15 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.155 -0.475 . . . . 1.9399999999999999 110.889 -179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 93.2 t -57.02 -50.24 76.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 CA-C-N 115.624 -0.716 . . . . 1.1399999999999999 111.231 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.634 ' HB2' HG21 ' B' ' 20' ' ' VAL . . . -54.94 -52.87 61.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.11 -0.496 . . . . 0.71999999999999997 112.16 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -57.23 -45.31 84.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.2 -0.455 . . . . 1.8899999999999999 111.736 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -56.47 -53.26 59.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.296 0.569 . . . . 1.46 111.636 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.45 ' CB ' ' HA ' ' B' ' 38' ' ' VAL . . . -73.96 -14.74 61.08 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.58 0.956 . . . . 0.67000000000000004 113.58 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.21 43.61 6.99 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 119.607 -1.282 . . . . 1.21 111.949 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.459 HG21 HG22 ' B' ' 38' ' ' VAL . 15.2 m -136.23 174.58 12.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.506 -0.553 . . . . 0.71999999999999997 109.506 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.456 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 89.9 p -109.02 152.23 25.28 Favored 'General case' 0 C--N 1.315 -0.909 0 C-N-CA 121.117 -0.233 . . . . 1.1000000000000001 110.671 -179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -44.39 -14.61 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 115.79 1.774 . . . . 1.49 115.79 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.516 ' CB ' ' H73' ' D' ' 6' ' ' ' DT' . 18.1 tp60 -85.48 -30.91 23.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.981 0.896 . . . . 1.4299999999999999 109.456 -177.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.75 -16.27 45.43 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.708 -0.678 . . . . 0.78000000000000003 111.684 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.634 HG21 ' HB2' ' B' ' 10' ' ' ALA . 2.7 t -75.8 -16.17 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 122.015 0.912 . . . . 1.0800000000000001 109.371 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.648 ' O ' ' HB2' ' B' ' 25' ' ' ASN . 30.2 t -90.11 -17.91 26.82 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 105.652 -1.981 . . . . 1.1200000000000001 105.652 -177.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -88.66 -43.95 10.95 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 112.383 -2.19 . . . . 1.8799999999999999 110.51 -176.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 38' ' ' VAL . 9.1 p -67.82 -39.0 81.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 120.563 -0.455 . . . . 1.3899999999999999 110.426 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.26 -57.56 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 N-CA-C 107.32 -1.363 . . . . 1.3100000000000001 107.32 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.648 ' HB2' ' O ' ' B' ' 21' ' ' SER . 8.6 t-20 -48.05 -39.74 20.92 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 113.922 -1.49 . . . . 2.1899999999999999 111.205 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 47.89 39.59 11.14 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.744 1.277 . . . . 3.2999999999999998 111.198 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -169.73 27.17 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.174 -0.921 . . . . 3.0800000000000001 112.311 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.91 -89.7 0.47 Allowed 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.665 -0.414 . . . . 3.25 110.881 -179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -135.36 7.75 3.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.715 -0.476 . . . . 1.75 109.715 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.4 ' HA ' ' OP1' ' D' ' 4' ' ' ' DT' . 0.2 OUTLIER -46.7 116.94 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 N-CA-C 114.032 1.123 . . . . 1.3500000000000001 114.032 -179.214 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.35 163.43 23.9 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.277 -1.379 . . . . 1.5800000000000001 107.277 176.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -57.0 -52.87 63.53 Favored 'General case' 0 CA--C 1.518 -0.257 0 O-C-N 121.782 -0.574 . . . . 1.27 110.993 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' B' ' 33' ' ' LYS . 7.3 mmpt? -52.45 -52.08 55.97 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.75 -0.659 . . . . 2.2000000000000002 110.799 179.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.451 ' O ' HG23 ' B' ' 38' ' ' VAL . 4.8 m -46.72 -57.18 5.09 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 113.136 0.791 . . . . 1.05 113.136 178.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.7 ptp180 -64.31 -39.88 94.81 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.181 0.437 . . . . 1.54 112.181 -178.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -62.72 -37.34 86.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.961 0.41 . . . . 1.97 110.659 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -61.21 1.88 Allowed 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.532 -0.467 . . . . 2.5 111.924 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.613 HG11 HG11 ' B' ' 23' ' ' VAL . 4.3 t -55.63 -34.04 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 N-CA-C 113.91 1.078 . . . . 1.3799999999999999 113.91 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -60.85 -25.56 66.74 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.214 -0.594 . . . . 2.0699999999999998 111.429 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.39 -46.56 85.87 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.592 -0.276 . . . . 0.91000000000000003 110.289 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.3 -37.15 84.75 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.479 -0.328 . . . . 0.72999999999999998 110.413 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -58.33 8.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.833 -0.621 . . . . 1.3999999999999999 111.303 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.86 88.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.215 0.531 . . . . 1.03 110.784 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -56.82 -53.77 54.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.234 -0.894 . . . . 2.1000000000000001 112.52 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 mt -91.08 -13.61 32.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 115.042 1.497 . . . . 0.83999999999999997 115.042 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 t30 64.11 73.41 0.43 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.089 0.859 . . . . 1.5600000000000001 111.698 -178.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -84.16 120.62 26.4 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.046 0.387 . . . . 0.88 112.046 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.61 116.52 38.74 Favored Pre-proline 0 C--N 1.323 -0.569 0 N-CA-C 107.81 -1.181 . . . . 1.6000000000000001 107.81 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.49 175.82 2.55 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.014 2.476 . . . . 1.45 115.016 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -129.66 117.44 20.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 113.899 -1.501 . . . . 1.0900000000000001 108.799 -179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.612 ' O ' ' HG2' ' B' ' 55' ' ' GLN . 23.1 tpt180 -64.53 -48.4 75.24 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 120.596 -0.441 . . . . 3.3900000000000001 110.626 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 91.9 m -54.26 -41.02 68.34 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-O 120.972 0.415 . . . . 0.82999999999999996 110.683 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.78 -54.65 41.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.44 -0.8 . . . . 0.63 110.853 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -61.61 -46.15 91.04 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.966 -0.561 . . . . 1.3300000000000001 111.791 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.612 ' HG2' ' O ' ' B' ' 51' ' ' ARG . 8.4 mm100 -59.49 -44.73 93.01 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.16 -0.473 . . . . 3.0299999999999998 111.428 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.555 ' CD2' HD23 ' A' ' 56' ' ' LEU . 35.1 tp -79.04 -18.1 54.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.117 0.484 . . . . 1.21 111.896 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.5 15.77 0.23 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.161 0.584 . . . . 0.98999999999999999 112.363 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -146.05 -97.79 0.22 Allowed Glycine 0 N--CA 1.438 -1.185 0 N-CA-C 110.107 -1.197 . . . . 2.0899999999999999 110.107 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -145.95 6.61 1.04 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.581 0.215 . . . . 5.9199999999999999 111.581 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.85 113.68 26.02 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.401 0.62 . . . . 4.8300000000000001 111.633 -178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 2.7 m -66.85 -44.44 81.02 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.063 -0.972 . . . . 6.0899999999999999 110.494 179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 17.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.11 -0.947 . . . . 7.79 110.157 -179.678 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.601 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.83 0 C3'-C2'-C1' 99.314 -2.419 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.119 0 C3'-C2'-C1' 99.73 -2.121 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.406 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.663 0 C3'-C2'-C1' 99.696 -2.146 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.48 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.9 0 C3'-C2'-C1' 99.917 -1.988 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.48 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.06 0 C3'-C2'-C1' 99.394 -2.362 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.479 H2'' ' C6 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.815 0 C3'-C2'-C1' 99.509 -2.279 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.479 ' C6 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.029 0 C3'-C2'-C1' 98.861 -2.742 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.42 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.42 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.804 0 C3'-C2'-C1' 99.438 -2.33 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.595 H2'' ' C5 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.503 -1.316 0 O4'-C1'-C2' 104.038 -1.875 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.595 ' C5 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -0.999 0 O4'-C1'-C2' 103.955 -1.95 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.568 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 C3'-C2'-C1' 100.24 -1.757 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.568 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.047 0 C3'-C2'-C1' 99.168 -2.523 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.752 0 O4'-C1'-C2' 103.691 -2.19 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.499 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.063 0 C3'-C2'-C1' 99.251 -2.463 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.499 ' C8 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.956 0 C3'-C2'-C1' 99.375 -2.375 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.975 0 C3'-C2'-C1' 99.459 -2.315 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.435 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.887 0 C3'-C2'-C1' 99.725 -2.125 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.522 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 98.99 -2.65 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.522 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.175 -2.518 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.642 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.504 -1.182 0 C3'-C2'-C1' 99.97 -1.95 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.642 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.297 -2.431 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.033 0 C3'-C2'-C1' 99.51 -2.279 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.678 0 N19-C1'-C2' 115.329 0.705 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.515 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 C3'-C2'-C1' 99.789 -2.079 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.515 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C2'-C3'-O3' 112.397 0.665 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.567 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 105.385 1.918 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.567 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.775 0 OP2-P-O3' 110.137 0.574 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.725 0 C3'-C2'-C1' 104.641 1.386 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.614 ' C6 ' ' H72' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 104.828 1.52 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.614 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C1'-O4'-C4' 107.369 -1.665 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.46 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 105.37 1.907 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.555 ' C6 ' ' H72' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.726 0 N19-C1'-C2' 115.134 0.584 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.555 ' H72' ' C6 ' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C3'-C2'-C1' 105.297 1.855 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.536 ' N4 ' ' N4 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.906 0 C4'-C3'-C2' 104.453 1.253 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 N19-C1'-C2' 116.103 1.189 . . . . 1.1899999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.487 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.406 -1.04 0 C1'-O4'-C4' 106.607 -2.21 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.522 ' OP1' ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 C2'--C1' 1.507 -1.006 0 C1'-O4'-C4' 107.656 -1.46 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.513 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O3'-P-O5' 102.594 -0.74 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.443 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 100.926 -1.267 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.484 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 C4'-C3'-C2' 105.091 1.891 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.484 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.618 0.953 0 C5'-C4'-C3' 116.284 1.056 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.449 ' OP2' H2'' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.411 -0.699 0 O4'-C1'-C2' 104.88 -1.109 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.45 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 O4'-C4'-C3' 106.083 0.483 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.45 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.004 0 C3'-C2'-C1' 99.807 -2.066 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.435 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.838 0 N19-C1'-C2' 116.11 1.194 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.532 ' HA ' ' OD1' ' A' ' 46' ' ' ASN . 73.4 mtp . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.074 0.464 . . . . 5.7999999999999998 110.331 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 45' ' ' LEU . 58.9 mtpt -122.11 145.81 44.92 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.724 -0.472 . . . . 5.3499999999999996 109.724 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -80.79 58.86 7.22 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.182 1.922 . . . . 2.4300000000000002 111.913 179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.529 ' O ' ' HD1' ' A' ' 47' ' ' TYR . 0.2 OUTLIER -92.17 149.15 4.24 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.501 -0.772 . . . . 1.03 110.947 -179.472 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.447 ' O ' HG23 ' A' ' 9' ' ' VAL . 51.3 p -98.51 178.29 5.06 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 123.834 0.709 . . . . 0.76000000000000001 110.614 178.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.451 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 1.6 pp -73.9 -23.45 59.56 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.554 -0.748 . . . . 0.98999999999999999 111.067 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -67.86 -35.39 78.46 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 109.303 -0.628 . . . . 1.51 109.303 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.47 -53.04 15.27 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.71 -0.677 . . . . 1.6699999999999999 110.082 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 5' ' ' THR . 14.9 t -53.6 -38.57 34.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 121.441 0.639 . . . . 0.70999999999999996 109.588 177.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.39 -51.68 68.44 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.383 -0.826 . . . . 0.68000000000000005 111.826 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.5 tt0 -60.99 -46.75 89.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.495 -0.32 . . . . 2.3999999999999999 111.188 179.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -62.47 -32.74 73.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.094 -0.503 . . . . 1.47 110.028 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.13 -23.75 47.67 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.729 -0.669 . . . . 0.77000000000000002 111.34 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.95 34.22 27.72 Favored Glycine 0 N--CA 1.462 0.391 0 C-N-CA 120.224 -0.989 . . . . 1.3700000000000001 111.945 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.4 m -137.77 -173.26 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.352 0 C-N-CA 122.942 0.497 . . . . 0.77000000000000002 109.93 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 86.2 p -79.26 -167.49 1.2 Allowed 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.986 -0.746 . . . . 1.3300000000000001 108.986 179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.451 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 51.7 p90 -96.67 -8.45 31.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.04 0.448 . . . . 1.3200000000000001 109.957 -178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.631 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 4.8 tp-100 -86.72 -25.5 24.71 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.948 0.404 . . . . 1.4399999999999999 109.972 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.64 -49.84 71.67 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.42 -0.809 . . . . 0.77000000000000002 111.531 -179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 24' ' ' VAL . 17.0 m -66.89 -43.07 89.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.807 0.336 . . . . 1.3799999999999999 111.223 -179.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -60.28 -38.99 85.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.08 0.467 . . . . 1.0800000000000001 112.21 -178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.451 ' HE ' HG23 ' A' ' 30' ' ' VAL . 4.4 ttp180 -64.03 -29.5 70.65 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.703 -0.681 . . . . 2.5499999999999998 112.1 -179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.624 ' HB ' HG11 ' A' ' 38' ' ' VAL . 25.8 t -84.58 -30.63 7.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.471 -0.331 . . . . 1.6299999999999999 110.601 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 20' ' ' VAL . 96.1 t -67.11 -24.26 31.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.983 0.897 . . . . 1.3799999999999999 109.947 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -103.73 -1.03 28.62 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.238 -0.892 . . . . 1.6100000000000001 110.417 -179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 54.02 47.63 22.94 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 114.418 -1.265 . . . . 3.7000000000000002 110.662 -179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.39 142.76 32.7 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.523 -0.308 . . . . 2.1000000000000001 111.143 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -86.42 67.11 9.81 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.056 0.455 . . . . 1.98 111.47 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -158.36 41.65 0.26 Allowed 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.216 -0.661 . . . . 1.3799999999999999 109.216 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG23 ' HE ' ' A' ' 22' ' ' ARG . 2.2 t -148.85 148.43 15.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.836 -1.075 . . . . 1.1100000000000001 109.715 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.432 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 17.2 m -73.78 172.68 11.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.979 0.418 . . . . 1.3200000000000001 111.348 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.44 -45.61 45.29 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 116.344 -0.389 . . . . 1.1299999999999999 111.159 -177.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 37.7 ttmt -63.75 -37.64 88.11 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.075 0.398 . . . . 1.75 112.075 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.435 ' O ' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -72.42 -34.17 67.64 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.652 -0.499 . . . . 0.98999999999999999 109.652 179.915 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 35' ' ' ARG . 6.4 ttt180 -64.78 -54.61 28.5 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.915 -0.584 . . . . 3.3399999999999999 110.843 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -57.74 -37.14 73.08 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.272 0.558 . . . . 1.76 110.23 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 1.8 ttmm -53.64 -51.64 62.45 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.748 -1.115 . . . . 1.45 110.993 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.624 HG11 ' HB ' ' A' ' 23' ' ' VAL . 69.8 t -63.53 -43.45 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 113.923 -1.489 . . . . 1.45 110.35 -179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 42' ' ' MET . 45.1 mt-10 -62.93 -45.49 92.22 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-N 116.362 -0.381 . . . . 1.8700000000000001 111.237 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.33 -40.41 77.6 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 120.92 -0.312 . . . . 0.88 111.591 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.53 87.64 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.189 -0.46 . . . . 0.70999999999999996 111.72 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.402 ' HG2' ' HA ' ' A' ' 39' ' ' GLU . 7.1 ptp -68.96 -32.16 71.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.002 -0.545 . . . . 1.47 111.11 -178.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.35 -38.33 42.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 120.346 -0.541 . . . . 0.93000000000000005 111.325 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.07 -46.33 84.79 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.274 0.559 . . . . 1.72 110.491 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.437 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 87.6 mt -82.51 -16.83 47.27 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 116.253 -0.431 . . . . 0.98999999999999999 110.71 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.532 ' OD1' ' HA ' ' A' ' 1' ' ' MET . 0.2 OUTLIER 61.4 56.95 2.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.113 0.483 . . . . 2.2000000000000002 110.512 -179.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.529 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 0.9 OUTLIER -81.44 131.22 35.27 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.631 -0.713 . . . . 1.23 110.959 -178.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.427 HD12 ' HD2' ' A' ' 49' ' ' PRO . 3.6 tp -109.57 113.31 58.15 Favored Pre-proline 0 N--CA 1.444 -0.767 0 N-CA-C 109.882 -0.414 . . . . 1.8799999999999999 109.882 177.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD2' HD12 ' A' ' 48' ' ' ILE . 66.2 Cg_exo -51.88 125.22 16.48 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 122.987 2.458 . . . . 0.83999999999999997 113.453 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -76.67 103.05 6.43 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.938 0.399 . . . . 1.1000000000000001 110.197 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -72.51 -11.23 60.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.183 -0.462 . . . . 4.7199999999999998 112.175 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.29 -34.15 49.01 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.327 -0.858 . . . . 0.77000000000000002 110.473 -178.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.537 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -80.29 -24.77 39.79 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 115.311 -0.859 . . . . 0.66000000000000003 109.242 178.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -67.25 -34.12 76.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.162 -0.926 . . . . 1.46 111.527 -179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.54 ' HB3' ' H ' ' A' ' 60' ' ' GLN . 44.7 mt-30 -86.7 -38.42 17.0 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 108.604 -0.888 . . . . 1.45 108.604 -179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' B' ' 56' ' ' LEU . 1.2 tp -51.39 -34.74 35.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.138 -0.937 . . . . 0.78000000000000003 111.656 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.57 4.3 0.59 Allowed 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.12 0.785 . . . . 1.0800000000000001 113.12 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 130.95 48.34 0.12 Allowed Glycine 0 C--N 1.335 0.525 0 C-N-CA 119.942 -1.123 . . . . 1.6599999999999999 114.771 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 49.4 mttm -149.33 -91.93 0.07 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.091 -0.707 . . . . 4.79 109.091 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.54 ' H ' ' HB3' ' A' ' 55' ' ' GLN . 0.2 OUTLIER 66.0 81.39 0.2 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.178 -0.919 . . . . 2.3399999999999999 110.212 179.284 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 7.4 m -110.42 111.91 23.49 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.935 -0.395 . . . . 3.8599999999999999 109.935 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.241 0.608 0 CA-C-O 118.124 -0.941 . . . . 6.96 110.546 -178.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 18.6 mmt . . . . . 0 N--CA 1.483 1.178 0 CA-C-O 120.951 0.405 . . . . 6.9199999999999999 110.206 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -83.5 160.41 59.26 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 116.359 -0.382 . . . . 6.4199999999999999 110.073 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -58.04 94.24 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 122.93 2.42 . . . . 2.1000000000000001 112.291 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 31.8 m -90.53 161.58 2.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-N 116.052 -0.522 . . . . 1.4299999999999999 110.497 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 11.8 p -77.61 163.18 26.47 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.842 0.312 . . . . 0.81000000000000005 111.842 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 6' ' ' LEU . 8.3 mt -70.85 -14.59 62.46 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 108.725 -0.843 . . . . 0.60999999999999999 108.725 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.23 -39.92 62.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.654 -0.703 . . . . 1.3200000000000001 109.941 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -59.17 -54.01 51.8 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 115.561 -0.745 . . . . 1.9399999999999999 111.181 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 3.8 m -63.79 -33.17 60.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-N 115.626 -0.715 . . . . 1.1399999999999999 110.344 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.0 -49.95 75.08 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.027 0.38 . . . . 0.71999999999999997 112.027 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -62.02 -32.39 72.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 115.816 -0.629 . . . . 1.8899999999999999 110.487 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 2.1 t80 -70.7 -48.91 52.21 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.618 -0.719 . . . . 1.46 110.616 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.68 -28.91 70.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.371 -0.831 . . . . 0.67000000000000004 112.423 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 78.74 44.63 10.19 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.189 -1.005 . . . . 1.21 111.914 -179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 3.5 m -147.49 -179.21 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-O 120.927 0.394 . . . . 0.71999999999999997 110.684 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.423 ' O ' HG23 ' B' ' 20' ' ' VAL . 52.9 m -84.65 143.34 29.29 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.139 0.495 . . . . 1.1000000000000001 112.137 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -51.63 -38.86 56.62 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.626 1.17 . . . . 1.49 111.934 -179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.67 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 0.8 OUTLIER -58.9 -54.13 50.56 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.237 -0.892 . . . . 1.4299999999999999 111.299 179.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.09 -32.24 69.62 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.466 -0.788 . . . . 0.78000000000000003 110.944 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.423 HG23 ' O ' ' B' ' 16' ' ' SER . 88.3 t -61.84 -48.78 87.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 CA-C-N 116.532 -0.304 . . . . 1.0800000000000001 111.458 178.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 10.8 t -61.99 -36.42 81.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 120.534 0.207 . . . . 1.1200000000000001 110.501 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.49 ' CZ ' ' H72' ' D' ' 4' ' ' ' DT' . 83.7 mtt180 -56.6 -38.98 72.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.288 0.566 . . . . 1.8799999999999999 110.279 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 38' ' ' VAL . 55.9 t -66.62 -43.67 90.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.934 -0.575 . . . . 1.3899999999999999 110.41 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.14 -38.53 82.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.949 -0.569 . . . . 1.3100000000000001 109.577 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -78.5 -10.37 59.69 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 116.318 -0.401 . . . . 2.1899999999999999 111.322 178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 48.11 43.39 18.31 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.414 1.086 . . . . 3.2999999999999998 111.241 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -160.07 164.05 33.43 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 122.615 1.198 . . . . 3.0800000000000001 112.347 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m 48.7 91.29 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 111.812 -2.449 . . . . 3.25 115.311 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 25.2 m80 65.18 59.84 0.81 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 113.97 1.1 . . . . 1.75 113.97 174.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 12.6 t -110.18 85.64 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 116.309 -0.405 . . . . 1.3500000000000001 111.262 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 29.8 t -58.74 146.2 37.6 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.163 -0.31 . . . . 1.5800000000000001 110.163 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.584 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.3 -48.76 70.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.162 0.506 . . . . 1.27 110.381 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.89 -45.43 74.67 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.927 -1.033 . . . . 2.2000000000000002 110.295 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 94.3 m -57.76 -49.88 75.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.618 -0.719 . . . . 1.05 111.62 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.584 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.8 ptp180 -67.3 -37.88 84.09 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 112.185 0.439 . . . . 1.54 112.185 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 12.0 tt0 -61.3 -50.05 74.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.327 0.512 . . . . 1.97 111.398 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -53.39 -46.4 69.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.843 -0.617 . . . . 2.5 112.475 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.4 HG21 HG21 ' B' ' 23' ' ' VAL . 13.5 m -75.83 -35.13 29.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 113.777 1.029 . . . . 1.3799999999999999 113.777 -177.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -68.89 -29.54 67.84 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 119.461 -0.896 . . . . 2.0699999999999998 109.561 -178.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.54 -48.0 81.42 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-O 121.317 0.58 . . . . 0.91000000000000003 110.103 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.425 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -67.14 -32.81 74.18 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.283 0.563 . . . . 0.72999999999999998 109.88 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.442 ' HB2' ' HA ' ' B' ' 39' ' ' GLU . 25.0 mtt -60.16 -48.13 83.02 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.001 -1.0 . . . . 1.3999999999999999 111.912 179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.72 -43.21 59.84 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.854 0.359 . . . . 1.03 111.788 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -64.06 -45.44 88.79 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.998 -0.547 . . . . 2.1000000000000001 112.208 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 96.9 mt -91.78 -15.67 27.97 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.696 -0.229 . . . . 0.83999999999999997 111.513 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 20.5 t30 65.35 68.5 0.49 Allowed 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.726 0.81 . . . . 1.5600000000000001 112.167 -179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -73.97 119.23 17.89 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.194 -0.457 . . . . 0.88 110.293 179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 31.5 mm -113.88 118.2 43.03 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 108.562 -0.903 . . . . 1.6000000000000001 108.562 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -56.68 113.56 1.52 Allowed 'Trans proline' 0 C--O 1.239 0.544 0 C-N-CA 122.398 2.066 . . . . 1.45 112.226 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.466 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 48.2 t-20 -61.07 112.79 2.23 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.239 -1.023 . . . . 1.0900000000000001 108.239 179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -60.55 -41.35 94.36 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.117 -0.492 . . . . 3.3900000000000001 111.925 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 m -71.41 -35.37 70.98 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 115.921 -0.581 . . . . 0.82999999999999996 112.384 -178.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.466 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -72.74 -53.93 10.32 Favored 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 120.817 -0.353 . . . . 0.63 110.978 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -52.9 -28.88 25.37 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.115 0.483 . . . . 1.3300000000000001 111.898 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.79 -49.02 16.88 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.891 -0.595 . . . . 3.0299999999999998 110.678 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.586 HD23 HD23 ' A' ' 56' ' ' LEU . 19.7 tp -76.82 -26.49 54.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.766 0.654 . . . . 1.21 112.766 -178.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.97 -6.27 21.35 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.969 -0.56 . . . . 0.98999999999999999 111.717 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.18 -90.13 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.811 -0.709 . . . . 2.0899999999999999 111.539 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.423 ' HB3' ' HE3' ' B' ' 59' ' ' LYS . 24.8 mtpp -150.8 -91.18 0.06 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.534 0.683 . . . . 5.9199999999999999 110.491 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -122.15 70.01 0.96 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.163 -0.926 . . . . 4.8300000000000001 110.399 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -97.48 103.31 15.23 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.496 -0.557 . . . . 6.0899999999999999 109.496 179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.243 0.753 0 CA-C-O 118.313 -0.851 . . . . 7.79 110.432 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.96 0 C3'-C2'-C1' 99.659 -2.172 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.191 0 O4'-C1'-C2' 103.582 -2.289 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.464 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.93 0 C3'-C2'-C1' 99.539 -2.258 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.511 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.824 0 C3'-C2'-C1' 99.156 -2.531 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.511 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.163 0 C3'-C2'-C1' 98.801 -2.785 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.632 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 99.478 -2.301 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.632 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 P--O3' 1.598 -0.73 0 C3'-C2'-C1' 99.364 -2.383 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.549 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.936 0 C3'-C2'-C1' 99.541 -2.257 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.813 0 C3'-C2'-C1' 99.007 -2.638 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.499 -1.573 0 C3'-C2'-C1' 99.522 -2.27 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.99 0 O4'-C1'-C2' 103.796 -2.095 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.531 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.252 0 C3'-C2'-C1' 99.514 -2.276 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.531 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.269 0 C3'-C2'-C1' 99.105 -2.568 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 C3'-C2'-C1' 100.027 -1.909 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.921 0 C3'-C2'-C1' 99.329 -2.408 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 C3'-C2'-C1' 99.608 -2.208 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 100.072 -1.877 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.565 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.769 0 C3'-C2'-C1' 99.465 -2.311 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.565 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.043 0 C3'-C2'-C1' 99.415 -2.347 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.472 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -0.979 0 C3'-C2'-C1' 99.271 -2.449 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.449 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.84 0 C3'-C2'-C1' 99.424 -2.34 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.453 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.275 -2.446 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.453 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.456 0.876 0 C3'-C2'-C1' 99.451 -2.321 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . 0.512 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.437 0.474 0 O4'-C4'-C3' 106.672 1.072 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.512 ' C8 ' H2'' ' D' ' -1' ' ' ' DC' . . . . . . . . 0 P--O3' 1.62 1.122 0 C3'-C2'-C1' 98.02 -3.343 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.404 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C5'-C4'-C3' 116.356 1.104 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.632 " H2'" ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C3'-C2'-C1' 105.532 2.023 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.632 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C4'-C3'-C2' 104.505 1.305 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 N19-C1'-C2' 115.575 0.86 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.67 ' H73' ' HB3' ' B' ' 18' ' ' GLN . . . . . . . . 0 P--O3' 1.617 0.875 0 C3'-C2'-C1' 105.673 2.124 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.587 " O5'" H2'' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.007 0 C1'-O4'-C4' 107.83 -1.336 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.693 0 C3'-C2'-C1' 100.96 -1.243 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.449 H2'' ' OP2' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.797 0 C3'-C2'-C1' 104.908 1.577 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.579 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.422 -1.118 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.579 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.621 1.146 0 P-O3'-C3' 120.779 0.899 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.792 " H1'" " O4'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.529 1.068 0 C3'-C2'-C1' 105.203 1.788 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.792 " O4'" " H1'" ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.403 -1.321 0 C1'-O4'-C4' 106.016 -2.632 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.585 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.528 0.976 0 O4'-C1'-C2' 104.782 -1.198 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.646 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.583 0 C3'-C2'-C1' 105.312 1.866 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.552 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.423 -1.065 0 C3'-C2'-C1' 100.994 -1.218 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.552 ' C5 ' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 N19-C1'-C2' 115.405 0.753 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.597 -0.864 0 O4'-C4'-C3' 106.327 0.727 . . . . 1.5600000000000001 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 N19-C1'-C2' 116.091 1.182 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.055 0 C1'-O4'-C4' 107.574 -1.519 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.614 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.129 0 C3'-C2'-C1' 99.737 -2.117 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.614 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.405 -1.163 0 C1'-O4'-C4' 107.307 -1.709 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.027 -0.36 . . . . 5.7999999999999998 110.027 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 106.33 57.81 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 116.362 -0.381 . . . . 5.3499999999999996 110.036 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.87 134.81 45.12 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.68 2.253 . . . . 2.4300000000000002 111.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.563 HG12 ' HB2' ' A' ' 8' ' ' ASP . 0.2 OUTLIER -82.09 117.37 27.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.787 -0.449 . . . . 1.03 109.787 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.2 p -96.26 -175.95 3.51 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 123.493 0.496 . . . . 0.76000000000000001 109.895 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.493 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -72.8 -15.65 61.63 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.372 -0.376 . . . . 0.98999999999999999 110.697 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -79.05 -39.08 34.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.253 -0.647 . . . . 1.51 109.253 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.563 ' HB2' HG12 ' A' ' 4' ' ' VAL . 6.9 m-20 -61.25 -56.46 20.35 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-O 121.465 0.65 . . . . 1.6699999999999999 109.385 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.9 t -56.0 -39.47 57.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 114.202 -1.363 . . . . 0.70999999999999996 109.939 178.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.66 -52.89 63.59 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.398 -0.365 . . . . 0.68000000000000005 111.254 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -62.45 -45.21 94.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 2.3999999999999999 111.293 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -61.25 -42.81 99.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.328 0.585 . . . . 1.47 110.318 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.09 -21.08 61.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.982 -1.008 . . . . 0.77000000000000002 111.588 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 73.17 32.95 59.76 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.85 -0.691 . . . . 1.3700000000000001 111.766 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -138.55 -167.34 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.414 -0.587 . . . . 0.77000000000000002 109.414 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 56.1 p -80.11 -178.89 6.76 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.962 0.411 . . . . 1.3300000000000001 110.723 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.493 ' O ' HD12 ' A' ' 6' ' ' LEU . 14.0 p90 -92.08 -10.8 37.71 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.492 0.663 . . . . 1.3200000000000001 109.701 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.403 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 4.4 tp-100 -80.21 -26.48 39.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.463 -0.79 . . . . 1.4399999999999999 110.254 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -41.97 99.31 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.932 -0.576 . . . . 0.77000000000000002 111.547 -179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.505 ' O ' HG23 ' A' ' 24' ' ' VAL . 7.7 m -71.57 -47.98 55.03 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 C-N-CA 120.568 -0.453 . . . . 1.3799999999999999 110.478 179.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 25.5 t -53.8 -39.29 65.35 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 112.333 0.494 . . . . 1.0800000000000001 112.333 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.1 tpp180 -58.12 -31.75 67.46 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.054 0.454 . . . . 2.5499999999999998 111.363 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.444 HG21 ' CG2' ' A' ' 38' ' ' VAL . 49.3 t -88.86 -28.21 5.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.063 -0.517 . . . . 1.6299999999999999 110.527 -178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 20' ' ' VAL . 47.4 t -64.25 -35.4 73.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 121.301 0.572 . . . . 1.3799999999999999 109.748 178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.414 HD21 ' P ' ' D' ' 14' ' ' ' DT' . 47.7 m-80 -93.37 7.05 46.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.728 -0.669 . . . . 1.6100000000000001 109.874 179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 54.2 44.97 28.32 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.162 -0.926 . . . . 3.7000000000000002 112.264 179.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.31 132.16 35.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.873 0.368 . . . . 2.1000000000000001 110.266 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.3 m -88.15 76.85 8.42 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.384 0.611 . . . . 1.98 111.085 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -153.33 49.48 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 1.3799999999999999 109.702 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 46.5 t -149.02 148.71 15.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.184 -0.916 . . . . 1.1100000000000001 109.416 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 m -74.46 144.29 44.28 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.428 -0.582 . . . . 1.3200000000000001 109.428 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -47.33 -47.19 25.81 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 112.824 0.676 . . . . 1.1299999999999999 112.824 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 22.9 ttpp -57.17 -42.64 81.49 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 123.511 0.507 . . . . 1.75 111.093 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.8 -35.39 44.32 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 116.288 -0.415 . . . . 0.98999999999999999 111.565 -179.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -61.81 -47.73 83.81 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.723 -0.473 . . . . 3.3399999999999999 109.723 179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -67.39 -33.61 75.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.642 0.734 . . . . 1.76 109.421 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 33' ' ' LYS . 15.9 ttmm -61.75 -50.95 70.32 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.756 -1.111 . . . . 1.45 112.18 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.444 ' CG2' HG21 ' A' ' 23' ' ' VAL . 17.3 m -68.28 -36.87 76.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.517 -0.31 . . . . 1.45 110.899 -179.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 97.3 mt-10 -62.63 -44.57 95.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.171 0.51 . . . . 1.8700000000000001 110.141 178.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.43 -39.55 85.45 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.898 -0.592 . . . . 0.88 110.978 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.84 -43.86 91.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.97 -0.559 . . . . 0.70999999999999996 111.872 -179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 12.6 ptt? -71.57 -30.36 65.76 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.412 -0.358 . . . . 1.47 111.122 -179.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.25 -39.47 65.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.171 0.51 . . . . 0.93000000000000005 110.498 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.55 -44.51 86.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 1.72 111.63 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HB3' HG11 ' A' ' 4' ' ' VAL . 84.3 mt -84.52 -10.83 57.08 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.619 -0.264 . . . . 0.98999999999999999 111.422 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.4 m120 61.93 52.11 3.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.343 0.592 . . . . 2.2000000000000002 110.324 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 4' ' ' VAL . 1.3 t80 -78.96 128.62 33.51 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.303 -0.862 . . . . 1.23 110.146 -179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -110.31 128.52 25.22 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.999 -0.371 . . . . 1.8799999999999999 109.999 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.73 116.82 4.16 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.607 2.205 . . . . 0.83999999999999997 112.388 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.573 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 57.9 t-20 -77.29 103.78 7.42 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.97 0.414 . . . . 1.1000000000000001 110.575 179.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.44 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 40.3 ttt180 -70.86 -20.01 62.57 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.561 0.578 . . . . 4.7199999999999998 112.561 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.2 m -65.75 -39.96 91.62 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 109.517 -0.549 . . . . 0.77000000000000002 109.517 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.514 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -78.92 -28.41 43.84 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.725 -0.671 . . . . 0.66000000000000003 110.096 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 91.7 mt-30 -58.71 -40.25 83.12 Favored 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.195 -0.911 . . . . 1.46 111.139 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 59' ' ' LYS . 69.5 mt-30 -77.22 -40.57 44.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 109.377 -0.601 . . . . 1.45 109.377 -178.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.597 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 22.6 tp -52.49 -41.55 63.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.973 -1.012 . . . . 0.78000000000000003 112.076 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.9 -14.66 62.83 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.479 0.918 . . . . 1.0800000000000001 113.479 -178.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.89 33.09 0.18 Allowed Glycine 0 CA--C 1.521 0.414 0 C-N-CA 119.513 -1.327 . . . . 1.6599999999999999 113.549 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.569 ' O ' HD23 ' A' ' 62' ' ' LEU . 14.6 mttt -131.84 21.68 4.59 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.921 -1.14 . . . . 4.79 107.921 178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -45.73 -54.04 8.51 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.089 -1.869 . . . . 2.3399999999999999 111.918 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.0 m -134.92 66.8 1.52 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.734 -0.469 . . . . 3.8599999999999999 109.734 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' O ' ' A' ' 59' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.399 -0.81 . . . . 6.96 111.168 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.48 1.071 0 N-CA-C 110.217 -0.29 . . . . 6.9199999999999999 110.217 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 5.9 ttpp -150.34 104.81 3.12 Favored Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.593 -0.276 . . . . 6.4199999999999999 110.507 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -87.9 -159.0 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.753 2.302 . . . . 2.1000000000000001 111.175 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.11 135.43 28.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 108.928 -0.768 . . . . 1.4299999999999999 108.928 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.65 ' O ' HG23 ' B' ' 9' ' ' VAL . 69.9 p -82.11 160.42 23.15 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 119.995 -0.682 . . . . 0.81000000000000005 110.788 -179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 6' ' ' LEU . 19.7 mt -68.48 -18.24 64.35 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.097 -0.501 . . . . 0.60999999999999999 109.92 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -64.44 -43.77 93.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.539 -0.755 . . . . 1.3200000000000001 109.677 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.19 -41.32 70.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.832 -1.076 . . . . 1.9399999999999999 110.353 -179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 5' ' ' THR . 9.3 t -58.0 -44.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.199 -0.91 . . . . 1.1399999999999999 110.693 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.4 -37.18 80.0 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.658 -0.701 . . . . 0.71999999999999997 111.661 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -71.15 -31.29 67.52 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.963 0.411 . . . . 1.8899999999999999 110.065 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -63.69 -54.71 31.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.6 0.714 . . . . 1.46 110.764 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' B' ' 37' ' ' LYS . . . -76.71 -14.27 59.96 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 114.195 -1.366 . . . . 0.67000000000000004 112.429 -178.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.19 46.8 20.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.001 -1.095 . . . . 1.21 112.476 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.1 m -139.25 177.94 4.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.949 -0.389 . . . . 0.71999999999999997 109.949 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.425 ' HB2' ' OG1' ' B' ' 19' ' ' THR . 21.4 m -89.31 146.3 24.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.825 0.345 . . . . 1.1000000000000001 111.24 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.43 ' OH ' ' C8 ' ' C' ' 12' ' ' ' DA' . 56.9 t80 -53.11 -45.51 68.32 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.08 0.952 . . . . 1.49 112.8 -178.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.478 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.2 OUTLIER -63.38 -40.83 98.31 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.299 -0.41 . . . . 1.4299999999999999 110.318 -179.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' B' ' 16' ' ' SER . 0.2 OUTLIER -61.94 -37.82 86.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.238 0.542 . . . . 0.78000000000000003 110.144 178.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -62.29 -44.79 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 115.622 -0.717 . . . . 1.0800000000000001 110.769 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.422 ' OG ' ' H73' ' C' ' 14' ' ' ' DT' . 0.0 OUTLIER -62.94 -36.78 84.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.394 -0.367 . . . . 1.1200000000000001 110.66 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' B' ' 27' ' ' ALA . 86.1 mtt180 -54.69 -41.98 70.88 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.996 -0.547 . . . . 1.8799999999999999 109.8 178.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.573 HG22 HG11 ' B' ' 30' ' ' VAL . 47.5 t -67.8 -46.69 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.317 -0.856 . . . . 1.3899999999999999 110.537 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -31.84 48.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.279 -0.873 . . . . 1.3100000000000001 112.682 -178.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.457 ' CG ' ' HG2' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -80.58 -37.88 30.5 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.987 -0.285 . . . . 2.1899999999999999 110.494 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.457 ' HG2' ' CG ' ' B' ' 25' ' ' ASN . 8.9 pt20 177.77 -57.29 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.345 -0.613 . . . . 3.2999999999999998 109.345 178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' B' ' 22' ' ' ARG . . . 178.24 -68.36 0.01 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 108.685 -0.857 . . . . 3.0800000000000001 108.685 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m 36.93 83.39 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 114.811 1.411 . . . . 3.25 114.811 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 74.8 m80 68.38 52.03 0.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.678 -0.692 . . . . 1.75 112.823 178.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.573 HG11 HG22 ' B' ' 23' ' ' VAL . 55.0 t -132.0 138.74 51.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.997 -0.547 . . . . 1.3500000000000001 110.492 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.499 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 15.0 m -80.22 151.22 29.77 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.536 -0.542 . . . . 1.5800000000000001 109.536 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -54.03 -51.52 63.76 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 112.164 0.431 . . . . 1.27 112.164 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -63.55 -30.66 71.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.728 0.299 . . . . 2.2000000000000002 110.533 179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 50.9 m -64.05 -44.28 92.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.711 -0.677 . . . . 1.05 110.685 179.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.607 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 9.3 ptp180 -75.62 -32.48 60.28 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-N 116.459 -0.337 . . . . 1.54 110.558 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -59.19 -43.43 92.22 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.423 -0.584 . . . . 1.97 109.423 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' HB1' ' B' ' 13' ' ' ALA . 12.5 mttt -57.81 -47.24 83.17 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.459 -0.791 . . . . 2.5 111.943 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 35' ' ' ARG . 4.5 m -69.66 -27.06 32.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.588 -0.278 . . . . 1.3799999999999999 111.583 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -70.04 -32.93 71.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.213 -0.662 . . . . 2.0699999999999998 109.213 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.1 -51.92 58.52 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.91000000000000003 109.097 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.35 -38.73 90.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 116.494 -0.321 . . . . 0.72999999999999998 110.877 178.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.0 mtm -57.54 -46.2 84.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.998 -0.546 . . . . 1.3999999999999999 111.219 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.26 -46.87 25.99 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.068 0.461 . . . . 1.03 111.032 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -56.28 -53.01 62.34 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.279 -0.873 . . . . 2.1000000000000001 111.68 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 50.4 mt -81.55 -11.97 58.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.129 -0.487 . . . . 0.83999999999999997 111.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 61.1 63.17 1.28 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.368 0.604 . . . . 1.5600000000000001 110.169 -178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -77.74 127.41 32.39 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.991 -0.55 . . . . 0.88 110.372 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.404 ' HA ' ' HD2' ' B' ' 49' ' ' PRO . 12.5 mt -121.3 111.21 33.72 Favored Pre-proline 0 C--N 1.314 -0.941 0 N-CA-C 107.585 -1.265 . . . . 1.6000000000000001 107.585 177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' B' ' 48' ' ' ILE . 10.4 Cg_endo -54.07 130.38 39.19 Favored 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.593 2.196 . . . . 1.45 113.19 -178.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -81.63 96.07 7.38 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.705 -1.22 . . . . 1.0900000000000001 107.705 178.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 17.2 tpp180 -56.6 -38.3 71.85 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.707 -0.224 . . . . 3.3900000000000001 111.429 -177.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 63.7 m -60.73 -39.63 89.37 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 116.605 -0.27 . . . . 0.82999999999999996 110.583 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.58 -43.57 59.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.448 -0.342 . . . . 0.63 110.963 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -57.34 -43.03 83.08 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.273 -0.421 . . . . 1.3300000000000001 112.071 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -69.7 -41.22 75.68 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.589 -0.523 . . . . 3.0299999999999998 109.589 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 53' ' ' ALA . 1.6 mt -64.15 -29.82 70.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.534 -1.212 . . . . 1.21 110.777 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.45 7.41 0.07 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.819 0.674 . . . . 0.98999999999999999 112.819 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' B' ' 56' ' ' LEU . . . 70.54 49.34 31.43 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 114.447 0.539 . . . . 2.0899999999999999 114.447 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -83.15 -44.42 15.1 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.989 0.395 . . . . 5.9199999999999999 110.413 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -95.11 111.95 23.71 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.14 -0.689 . . . . 4.8300000000000001 109.14 178.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 26.2 m -77.0 -20.14 56.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.55 -0.295 . . . . 6.0899999999999999 111.699 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--O 1.254 1.299 0 CA-C-O 118.226 -0.892 . . . . 7.79 111.456 178.914 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.446 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.883 0 C3'-C2'-C1' 99.383 -2.369 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.465 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.11 0 C3'-C2'-C1' 99.406 -2.353 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.465 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.707 0 C3'-C2'-C1' 99.922 -1.984 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.649 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 C3'-C2'-C1' 99.493 -2.291 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.649 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.968 -2.666 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.569 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.917 0 O4'-C1'-C2' 103.942 -1.962 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.569 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C3'-C2'-C1' 99.104 -2.569 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.766 0 C3'-C2'-C1' 99.805 -2.068 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 98.721 -2.842 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.494 H2'' ' C6 ' ' C' ' 10' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.501 -1.438 0 C3'-C2'-C1' 99.224 -2.483 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.494 ' C6 ' H2'' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.23 0 C3'-C2'-C1' 99.839 -2.043 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.621 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 99.689 -2.151 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.621 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.914 0 C3'-C2'-C1' 99.113 -2.562 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.511 -0.688 0 C3'-C2'-C1' 99.564 -2.24 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.445 H2'' ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.694 0 O4'-C1'-C2' 103.692 -2.189 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.478 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.51 -0.764 0 C3'-C2'-C1' 99.802 -2.07 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.085 0 C3'-C2'-C1' 99.508 -2.28 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C3'-C2'-C1' 99.618 -2.201 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.521 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.898 0 C3'-C2'-C1' 99.288 -2.437 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.521 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.537 -2.259 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.497 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C3'-C2'-C1' 99.933 -1.977 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.497 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 C3'-C2'-C1' 99.182 -2.513 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.49 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.139 0 C3'-C2'-C1' 99.341 -2.399 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . 0.401 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-P-OP1 106.661 -0.496 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.401 ' C8 ' H2'' ' D' ' -1' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.832 0 C3'-C2'-C1' 101.77 -0.664 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 C4'-C3'-C2' 102.396 -0.804 . . . . 1.97 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.602 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C1'-O4'-C4' 107.591 -1.507 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.602 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.408 -0.959 0 C4'-C3'-C2' 104.467 1.267 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.408 " H1'" " H5'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 C5'-C4'-C3' 116.29 1.06 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.408 " H5'" " H1'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.791 0 N19-C1'-C2' 115.946 1.091 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.569 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.713 0 C4'-C3'-C2' 104.319 1.119 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.569 ' C8 ' H2'' ' D' ' 7' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 105.388 1.92 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.727 0 O4'-C1'-C2' 107.109 0.917 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.677 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.044 0 C3'-C2'-C1' 98.098 -3.287 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.677 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.825 0 C4'-C3'-C2' 103.866 0.666 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.597 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.529 1.134 0 C3'-C2'-C1' 104.775 1.482 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.469 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O4'--C1' 1.407 -0.965 0 C1'-O4'-C4' 107.495 -1.575 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.554 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.411 -0.679 0 C3'-C2'-C1' 105.41 1.936 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.554 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 C3'-C2'-C1' 105.822 2.23 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.515 " O5'" " H1'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.621 1.192 0 P-O3'-C3' 120.659 0.799 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.468 ' C2 ' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 C3'-C2'-C1' 101.316 -0.989 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.486 ' C2 ' ' C2 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.732 0 C4'-C3'-C2' 103.988 0.788 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.559 " C2'" ' H71' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.559 ' H71' " C2'" ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 101.62 -0.772 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.403 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 C3'-C2'-C1' 100.362 -1.67 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.961 0 C4'-C3'-C2' 104.547 1.347 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.9 tmm? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.373 0.13 . . . . 5.7999999999999998 111.004 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.78 83.01 0.23 Allowed Pre-proline 0 N--CA 1.475 0.78 0 C-N-CA 123.513 0.725 . . . . 5.3499999999999996 111.272 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -63.39 140.35 76.01 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.245 1.964 . . . . 2.4300000000000002 111.631 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 47' ' ' TYR . 0.1 OUTLIER -78.86 115.84 21.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.9 -0.591 . . . . 1.03 109.764 179.319 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.2 p -102.96 -172.6 2.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.782 0.325 . . . . 0.76000000000000001 110.471 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.665 HD22 ' OG ' ' A' ' 21' ' ' SER . 3.2 pp -69.84 -23.13 63.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.498 -0.774 . . . . 0.98999999999999999 109.959 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -77.82 -10.18 59.42 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 122.839 0.455 . . . . 1.51 110.368 -178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -97.14 -56.76 2.45 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 104.714 -2.328 . . . . 1.6699999999999999 104.714 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 84.8 t -52.85 -55.82 10.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 CA-C-N 112.048 -2.342 . . . . 0.70999999999999996 112.716 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -48.14 -44.82 32.5 Favored 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 112.015 0.376 . . . . 0.68000000000000005 112.015 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.79 -41.97 70.95 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.448 -0.501 . . . . 2.3999999999999999 111.288 -179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -60.19 -37.16 79.39 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.2 -1.037 . . . . 1.47 108.2 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -28.9 40.19 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 113.801 -1.545 . . . . 0.77000000000000002 110.744 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 117.54 -62.53 0.41 Allowed Glycine 0 N--CA 1.438 -1.174 0 N-CA-C 111.558 -0.617 . . . . 1.3700000000000001 111.558 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.3 m -43.89 164.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 N-CA-C 116.502 2.038 . . . . 0.77000000000000002 116.502 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.4 m -75.69 144.16 41.75 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 113.657 -1.61 . . . . 1.3300000000000001 111.474 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.53 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 7.0 p90 -38.25 -23.94 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.122 0 N-CA-C 115.689 1.737 . . . . 1.3200000000000001 115.689 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.47 -32.8 14.75 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.151 1.341 . . . . 1.4399999999999999 112.286 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -50.69 -40.77 54.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.162 -0.472 . . . . 0.77000000000000002 111.09 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -72.12 -42.91 67.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.082 -0.508 . . . . 1.3799999999999999 110.895 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.665 ' OG ' HD22 ' A' ' 6' ' ' LEU . 4.1 m -58.54 -40.2 82.32 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 113.376 0.88 . . . . 1.0800000000000001 113.376 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.524 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 23.3 mtm-85 -58.14 -21.65 47.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.775 0.322 . . . . 2.5499999999999998 111.727 -179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 38' ' ' VAL . 53.0 t -89.75 -23.88 6.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.219 -0.446 . . . . 1.6299999999999999 110.55 -179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 49' ' ' PRO . 93.6 t -65.79 -54.47 27.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.696 0.284 . . . . 1.3799999999999999 110.805 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -78.65 -8.25 58.47 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 109.775 -0.454 . . . . 1.6100000000000001 109.775 177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 50.85 2.74 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.049 -0.978 . . . . 3.7000000000000002 112.022 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.26 147.47 52.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.86 0.362 . . . . 2.1000000000000001 110.524 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.8 m -85.3 63.76 8.28 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.221 0.534 . . . . 1.98 111.487 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.73 61.69 0.25 Allowed 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.264 -1.013 . . . . 1.3799999999999999 108.264 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.8 t -154.39 141.42 12.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.1100000000000001 111.865 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.6 m -84.02 149.98 25.91 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.169 -0.469 . . . . 1.3200000000000001 109.967 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.99 -54.42 43.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 113.121 0.785 . . . . 1.1299999999999999 113.121 -177.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -55.79 -46.49 77.98 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.15 0.5 . . . . 1.75 112.026 -179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -66.19 -33.44 75.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.569 -0.742 . . . . 0.98999999999999999 110.933 -179.36 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.7 ttt180 -64.86 -42.47 94.84 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.355 -0.384 . . . . 3.3399999999999999 110.571 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -63.22 -41.57 99.14 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.993 -0.683 . . . . 1.76 110.321 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.74 -40.1 86.98 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.504 -0.771 . . . . 1.45 112.72 -178.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.693 HG21 HG21 ' A' ' 23' ' ' VAL . 5.3 m -78.77 -35.04 17.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.947 -0.57 . . . . 1.45 111.243 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.79 -44.92 54.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.895 0.379 . . . . 1.8700000000000001 111.291 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.02 -39.99 79.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.04 -0.527 . . . . 0.88 112.368 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.71 43.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.063 0.394 . . . . 0.70999999999999996 112.063 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -72.55 -36.05 68.15 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.373 0.606 . . . . 1.47 110.509 -178.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.76 -5.25 59.15 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 124.1 0.96 . . . . 0.93000000000000005 111.763 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -86.49 -56.47 3.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.317 -1.734 . . . . 1.72 106.317 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 mt -75.84 -5.03 44.02 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 113.583 -1.644 . . . . 0.98999999999999999 110.973 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.9 t30 58.61 70.44 0.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.486 -0.779 . . . . 2.2000000000000002 111.255 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.553 ' HD2' ' O ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -90.68 143.32 26.86 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.929 -0.767 . . . . 1.23 108.929 178.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.29 124.17 31.24 Favored Pre-proline 0 N--CA 1.452 -0.365 0 N-CA-C 109.487 -0.56 . . . . 1.8799999999999999 109.487 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.47 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 20.4 Cg_exo -65.95 128.74 20.36 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.536 2.157 . . . . 0.83999999999999997 111.804 178.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.465 HD22 " H4'" ' D' ' 12' ' ' ' DG' . 31.7 t30 -86.84 106.62 17.86 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.138 0.494 . . . . 1.1000000000000001 110.169 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.29 -19.93 63.77 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.97 -0.559 . . . . 4.7199999999999998 112.278 -179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 57.4 m -63.04 -41.89 99.6 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.101 0.477 . . . . 0.77000000000000002 110.597 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.584 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -80.14 -32.96 38.87 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.375 -0.83 . . . . 0.66000000000000003 110.694 178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.487 ' HG2' " O3'" ' D' ' 13' ' ' ' DC' . 60.8 mt-30 -61.46 -41.98 98.06 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.742 0.645 . . . . 1.46 112.742 -178.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 38.5 mt-30 -86.55 -17.96 32.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.169 0.509 . . . . 1.45 110.25 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.737 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 18.0 tp -61.23 -44.09 97.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.892 -1.049 . . . . 0.78000000000000003 111.99 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.57 7.57 16.83 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.326 0.584 . . . . 1.0800000000000001 110.922 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -120.33 -120.08 2.77 Favored Glycine 0 N--CA 1.433 -1.558 0 CA-C-N 115.595 -0.73 . . . . 1.6599999999999999 113.077 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.4 mtmt -114.1 7.11 16.61 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.959 0.726 . . . . 4.79 112.959 -178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.541 ' NE2' H5'' ' C' ' 11' ' ' ' DG' . 0.5 OUTLIER 51.12 99.53 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.339 0.866 . . . . 2.3399999999999999 113.339 179.085 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.6 m -88.66 23.96 2.13 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 122.165 -0.334 . . . . 3.8599999999999999 111.497 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.181 -0.914 . . . . 6.96 111.137 -179.827 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 44.9 mtp . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.782 0.325 . . . . 6.9199999999999999 110.212 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -88.46 127.51 56.49 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.436 -0.347 . . . . 6.4199999999999999 110.233 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.415 ' O ' HG22 ' B' ' 4' ' ' VAL . 87.4 Cg_endo -83.39 -10.47 9.9 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.902 2.401 . . . . 2.1000000000000001 112.325 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.631 HG22 ' HA ' ' B' ' 47' ' ' TYR . 5.6 m 49.76 -154.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 124.704 1.252 . . . . 1.4299999999999999 111.431 -178.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.726 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 53.2 p -143.97 165.16 28.54 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 110.005 -0.369 . . . . 0.81000000000000005 110.005 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.57 ' HG ' ' CZ ' ' B' ' 47' ' ' TYR . 4.2 mt -74.16 -14.74 61.0 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 109.537 -0.542 . . . . 0.60999999999999999 109.537 178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -78.8 -38.63 37.85 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.145 -0.48 . . . . 1.3200000000000001 110.116 179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -65.8 -47.91 73.52 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 120.954 0.406 . . . . 1.9399999999999999 110.872 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB2' ' B' ' 47' ' ' TYR . 3.8 m -64.7 -36.48 77.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.729 -0.388 . . . . 1.1399999999999999 110.825 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.04 -37.79 77.8 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.865 0.364 . . . . 0.71999999999999997 110.92 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -65.48 -41.14 93.61 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.989 -0.551 . . . . 1.8899999999999999 111.132 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -67.28 -41.47 85.42 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.091 0.472 . . . . 1.46 111.088 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.53 -21.44 59.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 112.337 0.495 . . . . 0.67000000000000004 112.337 -178.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.03 37.28 25.78 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 119.935 -1.126 . . . . 1.21 111.549 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 24.0 m -130.88 -179.48 3.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 C-N-CA 122.893 0.477 . . . . 0.71999999999999997 109.991 -179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -100.27 164.23 12.04 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.705 0.288 . . . . 1.1000000000000001 110.309 179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.444 ' O ' HG12 ' B' ' 20' ' ' VAL . 49.2 t80 -56.0 -31.95 63.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.179 0.514 . . . . 1.49 111.562 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.666 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 13.5 tp60 -66.9 -47.42 71.85 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.956 -0.566 . . . . 1.4299999999999999 111.766 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -73.5 -33.65 64.9 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.906 0.335 . . . . 0.78000000000000003 111.906 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.444 HG12 ' O ' ' B' ' 17' ' ' TYR . 1.6 p -64.95 -47.42 88.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 111.894 0.331 . . . . 1.0800000000000001 111.894 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 38.6 t -65.45 -36.12 82.95 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.218 -0.29 . . . . 1.1200000000000001 110.218 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 10.1 mtt180 -55.76 -42.34 75.33 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.23 -0.441 . . . . 1.8799999999999999 110.38 179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.477 HG13 ' HB2' ' B' ' 35' ' ' ARG . 67.7 t -66.63 -45.65 87.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.538 -0.542 . . . . 1.3899999999999999 109.538 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 32.9 t -61.16 -45.54 98.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.382 -0.826 . . . . 1.3100000000000001 110.671 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.33 17.74 2.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.759 -0.655 . . . . 2.1899999999999999 112.082 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 40.96 39.85 0.91 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 124.224 0.952 . . . . 3.2999999999999998 111.078 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.33 176.18 5.51 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.777 0.658 . . . . 3.0800000000000001 112.777 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.3 m -95.01 171.1 8.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.592 -0.731 . . . . 3.25 111.955 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 62.19 39.97 12.18 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.562 -0.745 . . . . 1.75 110.923 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.466 HG11 HG22 ' B' ' 23' ' ' VAL . 2.7 t -120.7 120.99 64.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.927 -0.579 . . . . 1.3500000000000001 109.831 178.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . 0.514 ' HB2' ' OG1' ' B' ' 34' ' ' THR . 31.0 m -64.69 149.36 49.24 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.755 0.312 . . . . 1.5800000000000001 111.214 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -60.89 -42.42 97.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.589 -0.732 . . . . 1.27 110.776 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 9.1 tptp -61.67 -36.71 81.63 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.764 -0.653 . . . . 2.2000000000000002 110.848 179.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' B' ' 31' ' ' SER . 14.2 m -62.89 -49.21 75.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.082 -0.508 . . . . 1.05 111.691 -178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.566 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 5.1 ptp180 -67.4 -31.85 72.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.991 -0.55 . . . . 1.54 111.004 -179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -67.5 -43.87 79.87 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.024 0.44 . . . . 1.97 110.536 179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -63.35 -49.8 72.49 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.868 -0.605 . . . . 2.5 112.296 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.09 -26.48 41.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 N-CA-C 112.081 0.401 . . . . 1.3799999999999999 112.081 -178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -62.44 -33.69 75.31 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 109.647 -0.501 . . . . 2.0699999999999998 109.647 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.56 -53.95 49.48 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.438 -0.801 . . . . 0.91000000000000003 109.55 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.59 -46.71 80.69 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 116.269 -0.423 . . . . 0.72999999999999998 110.975 178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.1 mtm -51.77 -42.14 62.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.657 -0.701 . . . . 1.3999999999999999 112.249 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.18 -39.56 17.7 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.281 0.474 . . . . 1.03 112.281 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.79 -39.12 87.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.37 -0.377 . . . . 2.1000000000000001 111.999 -178.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -100.24 -16.4 17.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 111.923 0.342 . . . . 0.83999999999999997 111.923 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.7 t30 71.51 70.88 0.17 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.043 0.449 . . . . 1.5600000000000001 110.132 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.631 ' HA ' HG22 ' B' ' 4' ' ' VAL . 55.2 t80 -88.75 130.08 35.42 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 120.524 -0.47 . . . . 0.88 111.25 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 24.4 mm -111.19 127.47 26.84 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.169 -1.049 . . . . 1.6000000000000001 108.169 178.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.461 ' O ' H5'' ' C' ' 12' ' ' ' DA' . 56.9 Cg_exo -48.38 -33.9 23.92 Favored 'Trans proline' 0 C--N 1.354 0.854 0 C-N-CA 122.923 2.415 . . . . 1.45 112.149 -179.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . . . . . . . . . 43.0 t30 65.1 78.69 0.27 Allowed 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 122.094 0.949 . . . . 1.0900000000000001 109.542 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' OE1' ' B' ' 54' ' ' GLN . 0.0 OUTLIER -53.77 -29.02 38.24 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 114.329 -1.305 . . . . 3.3900000000000001 111.442 -178.589 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.67 -47.15 86.65 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.937 -0.574 . . . . 0.82999999999999996 111.538 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.425 ' HB3' " H5'" ' C' ' 12' ' ' ' DA' . . . -82.82 -36.21 25.72 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.023 0.44 . . . . 0.63 109.916 -179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.658 ' OE1' ' HD2' ' B' ' 51' ' ' ARG . 4.3 tt0 -55.53 -50.05 71.02 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.408 -0.815 . . . . 1.3300000000000001 111.514 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -68.08 -33.91 75.42 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.093 0.473 . . . . 3.0299999999999998 110.765 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.669 HD13 HD22 ' A' ' 56' ' ' LEU . 0.4 OUTLIER -61.52 -33.02 73.1 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 114.842 -1.072 . . . . 1.21 110.942 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.37 11.61 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 114.458 1.281 . . . . 0.98999999999999999 114.458 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 93.09 38.73 5.34 Favored Glycine 0 CA--C 1.507 -0.449 0 C-N-CA 120.682 -0.77 . . . . 2.0899999999999999 113.787 177.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.476 ' HE2' ' HA ' ' B' ' 59' ' ' LYS . 9.2 mmpt? -87.79 -29.12 21.24 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.953 0.406 . . . . 5.9199999999999999 110.327 178.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -119.99 101.27 7.74 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.859 -0.423 . . . . 4.8300000000000001 109.859 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . 0.427 ' C ' ' HG ' ' B' ' 62' ' ' LEU . 9.6 m -99.76 -10.08 22.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.359 . . . . 6.0899999999999999 111.68 -178.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.427 ' HG ' ' C ' ' B' ' 61' ' ' SER . 2.1 mt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.099 -0.953 . . . . 7.79 109.878 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.155 0 C3'-C2'-C1' 99.082 -2.584 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.425 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.365 0 O4'-C1'-C2' 103.988 -1.92 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.481 H2'' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.703 0 C3'-C2'-C1' 99.666 -2.167 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.825 H2'' ' H71' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.709 0 O4'-C1'-C2' 103.751 -2.135 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.825 ' H71' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.904 0 C3'-C2'-C1' 98.596 -2.931 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.747 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.454 0.722 0 C3'-C2'-C1' 99.961 -1.956 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.48 ' H73' ' C8 ' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.713 0 C3'-C2'-C1' 99.334 -2.404 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.423 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.821 0 C3'-C2'-C1' 99.891 -2.006 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.423 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.116 0 C3'-C2'-C1' 99.317 -2.416 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.5 -1.479 0 C3'-C2'-C1' 99.487 -2.295 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 103.953 -1.952 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.726 " H3'" HG22 ' B' ' 5' ' ' THR . . . . . . . . 0 P--O3' 1.621 1.125 0 C3'-C2'-C1' 99.496 -2.288 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.493 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.839 0 C3'-C2'-C1' 99.777 -2.088 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.536 H5'' ' HG3' ' B' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.736 0 O4'-C1'-C2' 103.745 -2.141 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.407 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.93 0 C3'-C2'-C1' 98.74 -2.828 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.598 -0.784 0 C3'-C2'-C1' 99.247 -2.466 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 C3'-C2'-C1' 99.198 -2.501 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.637 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.454 0.701 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.709 " H1'" ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.811 0 C3'-C2'-C1' 99.162 -2.527 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.709 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.512 -0.641 0 O4'-C1'-C2' 103.89 -2.009 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.553 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.862 0 C3'-C2'-C1' 99.775 -2.089 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.876 0 C3'-C2'-C1' 99.573 -2.234 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.108 0 C3'-C2'-C1' 99.764 -2.097 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 C3'-C2'-C1' 100.884 -1.297 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.654 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 N19-C1'-C2' 116.527 1.454 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.654 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.715 0 C3'-C2'-C1' 101.684 -0.726 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.546 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 105.232 1.809 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.661 H2'' ' C8 ' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.588 0 C3'-C2'-C1' 99.871 -2.021 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.661 ' C8 ' H2'' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.265 0 O4'-C1'-N19 108.47 0.837 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.666 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 P--O3' 1.618 0.878 0 C5'-C4'-C3' 116.747 1.364 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 107.666 -1.453 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.995 0 C1'-O4'-C4' 107.853 -1.319 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.742 H2'' " O5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.597 -0.805 0 C1'-O4'-C4' 107.144 -1.826 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.742 " O5'" H2'' ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.614 0 C3'-C2'-C1' 101.007 -1.209 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.446 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 N19-C1'-C2' 115.272 0.67 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.737 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.509 -0.832 0 C4'-C3'-C2' 104.557 1.357 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.487 " O3'" ' HG2' ' A' ' 54' ' ' GLN . . . . . . . . 0 O5'--C5' 1.426 -0.848 0 C1'-O4'-C4' 106.273 -2.448 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.673 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.408 -0.921 0 C3'-C2'-C1' 105.195 1.782 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.683 ' H6 ' " O5'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 P--O3' 1.616 0.742 0 O4'-C4'-C3' 104.337 -1.263 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.517 ' C8 ' H2'' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C4'-C3'-C2' 102.204 -0.996 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.524 H2'' ' N7 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.408 -0.929 0 O4'-C1'-C2' 104.62 -1.345 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.524 ' N7 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 C3'-C2'-C1' 103.97 0.907 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.913 0 N19-C1'-C2' 116.66 1.538 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.406 -1.045 0 C1'-O4'-C4' 107.368 -1.665 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.401 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.773 0 N19-C1'-C2' 116.778 1.611 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.401 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.412 -0.632 0 O4'-C4'-C3' 106.472 0.872 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.5 ttp . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.746 0.307 . . . . 5.7999999999999998 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -86.54 120.14 71.82 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.644 -0.502 . . . . 5.3499999999999996 109.644 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.26 114.32 1.97 Allowed 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.17 1.913 . . . . 2.4300000000000002 111.18 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.1 t -88.66 125.31 41.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 116.289 -0.414 . . . . 1.03 110.661 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.419 ' O ' HG23 ' A' ' 9' ' ' VAL . 40.9 p -113.22 -179.11 3.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.102 -0.499 . . . . 0.76000000000000001 109.96 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.498 HD12 ' O ' ' A' ' 17' ' ' TYR . 2.5 pt? -62.82 -18.45 62.8 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.656 -0.247 . . . . 0.98999999999999999 111.081 179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.15 -36.25 55.42 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 120.86 0.362 . . . . 1.51 110.719 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -73.1 -43.13 62.17 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.84 -0.8 . . . . 1.6699999999999999 108.84 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 5' ' ' THR . 39.0 t -61.51 -41.56 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.302 -0.863 . . . . 0.70999999999999996 110.493 178.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.473 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -60.33 -45.04 94.84 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.046 -0.525 . . . . 0.68000000000000005 111.149 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -61.48 -41.81 97.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.439 -0.801 . . . . 2.3999999999999999 110.966 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -74.81 -32.83 62.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.441 -0.8 . . . . 1.47 111.7 -179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.01 -25.57 43.29 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.935 0.398 . . . . 0.77000000000000002 111.521 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.37 34.95 15.47 Favored Glycine 0 CA--C 1.519 0.315 0 C-N-CA 120.933 -0.651 . . . . 1.3700000000000001 112.948 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.7 m -145.51 -173.03 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.541 -0.54 . . . . 0.77000000000000002 109.541 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 60.1 p -73.8 179.71 4.1 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.325 -0.621 . . . . 1.3300000000000001 109.325 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.498 ' O ' HD12 ' A' ' 6' ' ' LEU . 19.8 p90 -85.04 -21.66 29.31 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.739 -0.385 . . . . 1.3200000000000001 111.979 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.465 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.1 tt0 -75.06 -31.11 61.19 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.145 -0.622 . . . . 1.4399999999999999 110.478 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.5 -31.18 71.16 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.647 -0.501 . . . . 0.77000000000000002 109.647 178.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -66.07 -52.19 51.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 108.987 -0.745 . . . . 1.3799999999999999 108.987 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.456 ' HA ' HG23 ' A' ' 24' ' ' VAL . 2.4 t -63.81 -32.01 73.37 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.547 -0.751 . . . . 1.0800000000000001 111.364 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -35.86 65.45 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.971 0.73 . . . . 2.5499999999999998 112.971 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.4 m -89.48 -34.29 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 113.272 0.842 . . . . 1.6299999999999999 113.272 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.486 HG13 ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -70.84 -20.58 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 111.817 0.303 . . . . 1.3799999999999999 111.817 -178.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.551 ' O ' ' HB2' ' A' ' 26' ' ' GLN . 54.9 m-80 -102.31 -24.45 13.88 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 109.662 -0.495 . . . . 1.6100000000000001 109.662 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.551 ' HB2' ' O ' ' A' ' 25' ' ' ASN . 2.3 mp0 78.21 117.06 0.06 Allowed 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 105.688 -1.967 . . . . 3.7000000000000002 105.688 -176.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.33 -162.98 0.97 Allowed 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.686 -0.857 . . . . 2.1000000000000001 108.686 -177.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.1 m -127.08 -12.72 5.78 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.843 0.683 . . . . 1.98 112.843 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.493 ' HA ' ' OP2' ' C' ' 3' ' ' ' DA' . 32.5 m-70 -126.31 81.07 1.97 Allowed 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.283 -0.567 . . . . 1.3799999999999999 112.343 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.3 t -151.33 143.77 16.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.493 -0.776 . . . . 1.1100000000000001 111.356 179.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.0 m -86.16 140.91 29.76 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.986 0.422 . . . . 1.3200000000000001 110.84 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -48.84 -48.74 41.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.514 0.931 . . . . 1.1299999999999999 113.514 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 33' ' ' LYS . 25.1 ttmt -54.82 -50.13 69.32 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.8 0.333 . . . . 1.75 111.207 -179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -65.19 -39.48 92.9 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.712 -0.676 . . . . 0.98999999999999999 110.576 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -59.06 -47.26 85.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.189 -0.914 . . . . 3.3399999999999999 111.318 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.841 0.353 . . . . 1.76 111.801 -179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -44.52 94.78 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.674 -0.694 . . . . 1.45 112.25 -178.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 34' ' ' THR . 0.9 OUTLIER -71.93 -37.45 61.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.879 -0.328 . . . . 1.45 111.368 -179.606 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 42' ' ' MET . 38.7 mt-10 -66.42 -47.82 72.03 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.845 0.355 . . . . 1.8700000000000001 111.216 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.95 -39.03 90.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.118 0.485 . . . . 0.88 111.072 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.09 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.684 -0.689 . . . . 0.70999999999999996 111.589 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.601 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 19.7 ptt? -71.78 -25.93 62.22 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.356 -0.384 . . . . 1.47 111.598 -178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.89 -41.05 21.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.896 0.379 . . . . 0.93000000000000005 110.086 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -60.58 -47.45 86.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.714 -0.676 . . . . 1.72 110.381 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 56.0 mt -84.35 -11.76 55.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.948 -0.569 . . . . 0.98999999999999999 111.158 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.03 68.62 0.76 Allowed 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.667 0.746 . . . . 2.2000000000000002 110.247 -178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -96.8 132.1 42.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.353 -0.84 . . . . 1.23 110.594 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 48' ' ' ILE . 11.9 pt -110.68 119.78 45.48 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.689 -0.687 . . . . 1.8799999999999999 109.703 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -61.86 107.73 0.57 Allowed 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 121.899 1.733 . . . . 0.83999999999999997 111.181 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 50.0 t-20 -58.09 118.49 5.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.365 0.602 . . . . 1.1000000000000001 111.276 -178.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 24.5 ttp180 -82.52 -19.13 39.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.68 -0.691 . . . . 4.7199999999999998 111.786 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.44 -39.84 81.36 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 122.09 -0.381 . . . . 0.77000000000000002 110.551 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.62 -17.99 46.24 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.331 -0.618 . . . . 0.66000000000000003 109.331 179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 44.5 mt-30 -64.73 -38.28 90.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.293 -0.867 . . . . 1.46 111.58 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -86.91 -40.29 14.98 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 108.686 -0.857 . . . . 1.45 108.686 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.699 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 15.2 tp -47.76 -38.41 15.47 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-N 114.921 -1.036 . . . . 0.78000000000000003 111.827 178.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.93 1.85 2.4 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.154 0.798 . . . . 1.0800000000000001 113.154 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 106.98 43.01 1.45 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.0 -0.619 . . . . 1.6599999999999999 112.607 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -130.8 14.05 5.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.906 0.384 . . . . 4.79 110.853 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.8 mp0 -56.26 -31.44 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.789 -0.642 . . . . 2.3399999999999999 111.304 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 70.24 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 3.8599999999999999 111.136 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-N 115.814 -0.63 . . . . 6.96 109.796 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.003 0.43 . . . . 6.9199999999999999 110.986 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -102.64 140.52 21.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 C-N-CA 120.829 -0.348 . . . . 6.4199999999999999 110.522 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -82.51 -169.44 0.75 Allowed 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 122.56 2.173 . . . . 2.1000000000000001 111.938 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -71.51 134.42 29.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.055 -0.975 . . . . 1.4299999999999999 109.536 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.517 ' O ' HG23 ' B' ' 9' ' ' VAL . 29.2 p -79.89 162.67 24.87 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 120.972 0.415 . . . . 0.81000000000000005 110.388 -179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.4 mt -68.28 -18.2 64.48 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.911 -0.586 . . . . 0.60999999999999999 110.155 -179.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -68.0 -47.21 69.12 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.929 -0.578 . . . . 1.3200000000000001 109.544 178.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.34 -46.28 89.06 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.873 -1.058 . . . . 1.9399999999999999 110.006 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 5' ' ' THR . 34.1 t -54.89 -48.55 74.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 CA-C-N 114.518 -1.219 . . . . 1.1399999999999999 111.751 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . 0.453 ' HA ' HG21 ' B' ' 20' ' ' VAL . . . -56.88 -48.22 78.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.896 -0.593 . . . . 0.71999999999999997 112.077 -179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -65.11 -35.71 81.97 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 122.137 -0.352 . . . . 1.8899999999999999 110.648 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -58.23 -42.55 86.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.934 0.873 . . . . 1.46 109.602 178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.64 -15.4 57.68 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.098 -1.41 . . . . 0.67000000000000004 111.939 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 100.04 -54.05 0.93 Allowed Glycine 0 N--CA 1.445 -0.763 0 N-CA-C 110.97 -0.852 . . . . 1.21 110.97 -179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.3 m -56.59 -174.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 115.6 1.704 . . . . 0.71999999999999997 115.6 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.559 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 46.1 p -88.8 162.47 16.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.301 -1.772 . . . . 1.1000000000000001 112.6 -178.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.54 -42.53 96.7 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 114.589 -1.187 . . . . 1.49 110.846 179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.63 ' HB3' ' H73' ' D' ' 6' ' ' ' DT' . 1.4 tp60 -53.96 -58.66 6.46 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.898 -1.046 . . . . 1.4299999999999999 111.509 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.422 ' O ' HG23 ' B' ' 23' ' ' VAL . 0.2 OUTLIER -55.99 -33.93 65.29 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.511 -0.768 . . . . 0.78000000000000003 111.856 -179.055 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.453 HG21 ' HA ' ' B' ' 10' ' ' ALA . 4.0 t -65.07 -51.71 62.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 O-C-N 123.098 0.249 . . . . 1.0800000000000001 111.255 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 45.6 t -69.97 -37.9 75.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.954 0.406 . . . . 1.1200000000000001 110.491 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.576 ' HG2' ' HB3' ' B' ' 27' ' ' ALA . 22.4 ttm180 -52.95 -31.35 39.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.488 -0.778 . . . . 1.8799999999999999 111.156 178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 19' ' ' THR . 50.4 t -73.92 -43.19 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.309 -0.997 . . . . 1.3899999999999999 108.309 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 t -61.66 -51.29 74.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 114.626 -1.17 . . . . 1.3100000000000001 110.436 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -80.28 10.79 4.1 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.29 0.567 . . . . 2.1899999999999999 111.811 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 32.77 52.56 0.31 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 113.982 -1.463 . . . . 3.2999999999999998 113.139 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.576 ' HB3' ' HG2' ' B' ' 22' ' ' ARG . . . -62.96 154.6 29.92 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.187 0.44 . . . . 3.0800000000000001 112.187 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -35.94 -54.41 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 115.688 1.736 . . . . 3.25 115.688 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -102.74 81.66 2.04 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.253 0.835 . . . . 1.75 113.253 -176.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.538 HG23 ' O ' ' B' ' 27' ' ' ALA . 66.5 t -126.55 108.28 18.74 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 114.423 -1.262 . . . . 1.3500000000000001 109.696 175.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 11.3 t -54.21 143.74 22.04 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.92 -0.4 . . . . 1.5800000000000001 109.92 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.422 ' HA ' ' NE ' ' B' ' 35' ' ' ARG . . . -72.3 -6.82 45.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.01 0.374 . . . . 1.27 112.01 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -95.43 -48.17 5.97 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.306 -1.738 . . . . 2.2000000000000002 106.306 -177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.408 ' O ' HG13 ' B' ' 38' ' ' VAL . 57.1 m -51.26 -37.01 44.85 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 112.892 -1.958 . . . . 1.05 112.661 178.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.422 ' NE ' ' HA ' ' B' ' 32' ' ' ALA . 13.1 ptp180 -62.73 -29.66 70.85 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.769 -0.372 . . . . 1.54 110.215 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -76.51 -42.24 44.02 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 116.187 -0.46 . . . . 1.97 110.208 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -40.5 91.63 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.362 -0.381 . . . . 2.5 111.71 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.408 HG13 ' O ' ' B' ' 34' ' ' THR . 3.3 m -73.82 -27.39 22.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.187 -0.605 . . . . 1.3799999999999999 110.685 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -67.7 -25.05 65.48 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 109.865 -0.42 . . . . 2.0699999999999998 109.865 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.9 -62.03 2.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.516 -0.766 . . . . 0.91000000000000003 109.794 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.81 85.24 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.133 -0.485 . . . . 0.72999999999999998 111.174 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.36 -54.13 44.69 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.997 -0.547 . . . . 1.3999999999999999 111.883 -179.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.22 -43.29 28.81 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.983 0.364 . . . . 1.03 111.983 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -45.68 81.61 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 123.039 0.212 . . . . 2.1000000000000001 111.115 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 mt -83.74 -6.24 59.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.537 -0.302 . . . . 0.83999999999999997 111.747 -179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.91 65.09 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.503 0.668 . . . . 1.5600000000000001 111.585 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -75.03 131.9 40.93 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.88 109.957 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 41.5 mt -120.03 119.17 31.13 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 109.106 -0.701 . . . . 1.6000000000000001 109.106 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -56.81 120.78 8.92 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.954 1.77 . . . . 1.45 111.631 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.705 ' HB3' ' HB3' ' B' ' 53' ' ' ALA . 43.2 t-20 -74.67 105.09 5.59 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.162 -0.681 . . . . 1.0900000000000001 109.162 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.48 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 3.9 tpt180 -53.63 -39.95 65.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.059 -0.518 . . . . 3.3900000000000001 110.986 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 56' ' ' LEU . 91.2 m -74.87 -47.11 31.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 116.495 -0.321 . . . . 0.82999999999999996 111.757 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.705 ' HB3' ' HB3' ' B' ' 50' ' ' ASN . . . -63.57 -52.78 59.51 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 121.067 -0.253 . . . . 0.63 111.569 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -53.27 -45.02 68.68 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.162 0.506 . . . . 1.3300000000000001 111.565 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.48 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -72.19 -36.13 69.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.773 -0.648 . . . . 3.0299999999999998 111.568 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.547 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.06 -32.52 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.237 -0.438 . . . . 1.21 111.557 -179.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.23 -45.26 80.03 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 120.648 -0.421 . . . . 0.98999999999999999 110.636 -179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.45 31.22 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 118.154 -1.974 . . . . 2.0899999999999999 111.381 174.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.47 ' HE2' " H4'" ' C' ' 13' ' ' ' DG' . 24.6 mtmt -141.6 43.87 1.73 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.741 -0.229 . . . . 5.9199999999999999 110.654 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.466 ' OE1' ' HG3' ' B' ' 55' ' ' GLN . 20.1 mm-40 -42.71 94.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.876 0.695 . . . . 4.8300000000000001 112.876 178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 4.6 p -106.36 -14.21 15.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.091 -0.504 . . . . 6.0899999999999999 109.824 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.4 mt . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.979 -1.009 . . . . 7.79 111.506 179.862 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.263 0 C3'-C2'-C1' 99.297 -2.431 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.572 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.234 0 C3'-C2'-C1' 99.709 -2.136 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.572 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.886 0 O4'-C1'-C2' 103.939 -1.965 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.493 ' OP2' ' HA ' ' A' ' 29' ' ' HIS . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.626 -2.195 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.401 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.917 0 C3'-C2'-C1' 99.108 -2.566 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.483 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.714 0 C3'-C2'-C1' 99.751 -2.106 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.515 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.09 0 C3'-C2'-C1' 98.714 -2.847 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.52 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.071 0 C3'-C2'-C1' 99.571 -2.235 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.52 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.023 0 C3'-C2'-C1' 99.107 -2.566 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.334 0 C3'-C2'-C1' 99.759 -2.101 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.786 0 O4'-C1'-C2' 104.047 -1.866 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.669 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.908 0 C3'-C2'-C1' 99.891 -2.007 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.555 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.026 0 C3'-C2'-C1' 98.815 -2.775 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.47 " H4'" ' HE2' ' B' ' 59' ' ' LYS . . . . . . . . 0 C2'--C1' 1.509 -0.844 0 C3'-C2'-C1' 99.739 -2.115 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.802 0 C3'-C2'-C1' 99.493 -2.29 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.915 0 C3'-C2'-C1' 99.674 -2.161 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.881 0 C3'-C2'-C1' 99.704 -2.14 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.627 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 99.673 -2.162 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.627 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.683 0 C3'-C2'-C1' 99.234 -2.476 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.562 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.01 0 C3'-C2'-C1' 99.651 -2.178 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.597 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.858 0 C3'-C2'-C1' 99.83 -2.05 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.597 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.916 0 C3'-C2'-C1' 99.425 -2.339 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.002 0 C3'-C2'-C1' 99.682 -2.155 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.854 0 C4'-C3'-C2' 104.247 1.047 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.599 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 C3'-C2'-C1' 100.022 -1.913 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.599 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 P--O3' 1.613 0.515 0 C4'-C3'-C2' 102.325 -0.875 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.452 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.803 0 C3'-C2'-C1' 105.456 1.968 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.452 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 100.81 -1.35 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.403 H2'' ' OP2' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.765 0 C3'-C2'-C1' 104.47 1.264 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.63 ' H73' ' HB3' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C3'-C2'-C1' 104.139 1.028 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.502 ' H72' ' C6 ' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 C1'-O4'-C4' 106.978 -1.944 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C4'-C3'-C2' 104.397 1.197 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 C3'-C2'-C1' 101.165 -1.097 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.536 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.443 0.937 0 C4'-C3'-C2' 104.586 1.386 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.536 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.622 1.273 0 P-O3'-C3' 120.89 0.992 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.699 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.176 0 C4'-C3'-C2' 104.563 1.363 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.423 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.407 -0.969 0 C1'-O4'-C4' 107.232 -1.763 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.573 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.819 0 C3'-C2'-C1' 105.298 1.856 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.573 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.616 0.734 0 C3'-C2'-C1' 106.577 2.769 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.777 " H1'" " O4'" ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.277 0 C3'-C2'-C1' 105.567 2.048 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.777 " O4'" " H1'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.906 0 C4'-C3'-C2' 104.214 1.014 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.579 0 C4'-C3'-C2' 102.201 -0.999 . . . . 1.5600000000000001 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.414 ' C5 ' ' H73' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 C3'-C2'-C1' 101.198 -1.073 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.414 ' H73' ' C5 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.409 -0.838 0 C1'-O4'-C4' 106.962 -1.956 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.505 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.88 0 C3'-C2'-C1' 101.062 -1.17 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.505 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.83 0 N19-C1'-C2' 115.248 0.655 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.2 tpp . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.577 0.227 . . . . 5.7999999999999998 110.969 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -80.88 125.16 80.73 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.84 -0.43 . . . . 5.3499999999999996 109.84 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.45 86.6 1.15 Allowed 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 121.758 1.639 . . . . 2.4300000000000002 111.667 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 4' ' ' VAL . 0.3 OUTLIER -69.54 166.15 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 N-CA-C 108.983 -0.747 . . . . 1.03 108.983 179.1 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -134.86 165.26 25.72 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.929 0.395 . . . . 0.76000000000000001 110.065 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 17' ' ' TYR . 0.7 OUTLIER -66.17 -22.26 66.36 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 110.017 -0.364 . . . . 0.98999999999999999 110.017 178.418 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -70.78 -34.76 72.13 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.29 -0.633 . . . . 1.51 109.29 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -65.54 -58.43 5.81 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.711 -0.677 . . . . 1.6699999999999999 110.541 179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.7 -37.23 31.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.035 -0.984 . . . . 0.70999999999999996 110.504 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.484 ' HB2' ' HA ' ' A' ' 17' ' ' TYR . . . -57.26 -45.36 84.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.04 -0.982 . . . . 0.68000000000000005 110.853 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -67.01 -44.79 79.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.578 -0.737 . . . . 2.3999999999999999 110.406 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 7.7 t80 -64.71 -30.76 71.78 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.855 -0.611 . . . . 1.47 110.369 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -82.98 -18.19 40.76 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.284 -0.417 . . . . 0.77000000000000002 111.588 179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.93 38.1 27.75 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 121.281 -0.485 . . . . 1.3700000000000001 112.532 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.489 HG11 ' CG2' ' A' ' 34' ' ' THR . 16.9 m -148.87 -168.92 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.02 -0.363 . . . . 0.77000000000000002 110.02 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.3 m -74.96 -170.21 1.06 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.934 -0.121 . . . . 1.3300000000000001 110.895 178.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.587 ' HB2' HD12 ' A' ' 6' ' ' LEU . 30.3 p90 -100.32 -8.19 23.67 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.56 0.578 . . . . 1.3200000000000001 112.56 -176.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HG2' ' A' ' 22' ' ' ARG . 8.2 tt0 -88.33 -26.57 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.155 -0.618 . . . . 1.4399999999999999 109.433 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -39.36 89.7 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.495 -0.775 . . . . 0.77000000000000002 110.381 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.693 ' O ' HG22 ' A' ' 23' ' ' VAL . 7.6 p -71.15 -43.59 75.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 109.751 -0.463 . . . . 1.3799999999999999 109.751 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.3 t -59.83 -23.81 63.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.488 0.551 . . . . 1.0800000000000001 112.488 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 36.7 mmt180 -60.79 -26.38 67.24 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 121.017 -0.273 . . . . 2.5499999999999998 111.712 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.693 HG22 ' O ' ' A' ' 20' ' ' VAL . 33.2 m -88.77 -21.63 6.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 121.38 0.609 . . . . 1.6299999999999999 109.94 -179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.2 t -77.86 -26.05 14.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 114.969 -1.014 . . . . 1.3799999999999999 110.574 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -105.1 12.62 31.9 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.121 -0.696 . . . . 1.6100000000000001 109.121 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 51.56 39.94 25.95 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 114.805 -1.088 . . . . 3.7000000000000002 112.201 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.62 128.51 36.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.355 -0.384 . . . . 2.1000000000000001 110.073 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -92.25 62.81 4.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.693 -0.484 . . . . 1.98 109.693 179.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 51.82 1.8 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.106 0.479 . . . . 1.3799999999999999 111.241 -179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 43.5 t -148.49 144.6 18.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.436 -0.802 . . . . 1.1100000000000001 109.263 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.2 m -71.38 144.53 49.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.435 -0.209 . . . . 1.3200000000000001 110.435 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.09 -48.51 11.99 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.839 0.681 . . . . 1.1299999999999999 112.839 -178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -57.38 -45.91 83.97 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 111.814 0.302 . . . . 1.75 111.814 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.489 ' CG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -74.14 -34.26 63.82 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.674 0.273 . . . . 0.98999999999999999 110.314 -179.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.56 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -60.64 -59.04 6.02 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.759 -0.655 . . . . 3.3399999999999999 109.355 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -56.88 -36.27 69.9 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.43 -0.804 . . . . 1.76 111.098 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -62.22 -51.81 66.27 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.895 0.332 . . . . 1.45 111.895 -179.876 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.17 -30.53 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-O 120.942 0.401 . . . . 1.45 111.48 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 44.3 mt-10 -68.1 -51.3 47.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.282 -0.417 . . . . 1.8700000000000001 111.164 -179.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.64 -34.86 76.45 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.042 0.448 . . . . 0.88 110.666 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.22 98.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.251 -0.886 . . . . 0.70999999999999996 111.851 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.3 ppp? -69.8 -33.58 72.56 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.961 -0.563 . . . . 1.47 111.436 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.14 -35.47 64.08 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.543 0.211 . . . . 0.93000000000000005 110.525 179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -57.75 -50.74 72.23 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.833 -0.622 . . . . 1.72 111.521 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 95.9 mt -89.14 -0.76 57.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.393 -0.367 . . . . 0.98999999999999999 111.639 -179.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.5 t30 52.21 60.06 4.09 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.067 0.854 . . . . 2.2000000000000002 109.893 -178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -84.75 130.48 34.68 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.108 -0.951 . . . . 1.23 110.976 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ILE . 16.2 pt -120.61 124.77 27.44 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.591 -0.892 . . . . 1.8799999999999999 108.591 177.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.631 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 32.1 Cg_endo -62.16 130.59 31.15 Favored 'Trans proline' 0 C--N 1.33 -0.411 0 C-N-CA 122.126 1.884 . . . . 0.83999999999999997 111.583 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.549 ' HB3' " H5'" ' D' ' 13' ' ' ' DC' . 36.1 t-20 -60.56 111.53 1.63 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.41 0.624 . . . . 1.1000000000000001 109.464 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.64 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 7.9 mpt_? -68.67 -22.44 64.39 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.482 -0.781 . . . . 4.7199999999999998 112.558 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.3 m -78.42 -56.21 4.62 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.949 -1.13 . . . . 0.77000000000000002 107.949 177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' ASN . . . -51.98 -37.53 53.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.393 -1.276 . . . . 0.66000000000000003 112.566 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.64 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 3.7 pt20 -71.41 -24.3 62.02 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.986 -0.686 . . . . 1.46 111.711 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.615 ' HG3' ' O ' ' A' ' 51' ' ' ARG . 69.0 mt-30 -86.14 -38.5 17.66 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 108.788 -0.819 . . . . 1.45 108.788 178.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.829 HD22 HD13 ' B' ' 56' ' ' LEU . 12.6 tp -55.46 -36.68 66.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.551 -1.204 . . . . 0.78000000000000003 111.129 179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -3.35 4.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.511 0.559 . . . . 1.0800000000000001 112.511 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 118.11 40.66 0.68 Allowed Glycine 0 C--O 1.225 -0.437 0 C-N-CA 120.92 -0.657 . . . . 1.6599999999999999 113.108 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 91.2 mttt -134.59 12.37 3.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.84 0.352 . . . . 4.79 110.792 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -63.83 103.45 0.57 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.248 0.547 . . . . 2.3399999999999999 111.234 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 m -75.92 124.82 27.97 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.76 -0.655 . . . . 3.8599999999999999 110.262 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.808 -0.615 . . . . 6.96 110.17 179.359 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 110.285 -0.265 . . . . 6.9199999999999999 110.285 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.483 ' HZ2' " H3'" ' C' ' 11' ' ' ' DG' . 15.2 tppt? -168.61 98.45 0.54 Allowed Pre-proline 0 CA--C 1.534 0.329 0 O-C-N 123.721 0.638 . . . . 6.4199999999999999 110.026 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.529 ' HG3' ' HB ' ' B' ' 48' ' ' ILE . 51.6 Cg_endo -82.82 -73.35 0.01 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.082 0 C-N-CA 122.055 1.837 . . . . 2.1000000000000001 111.538 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 p -155.74 148.34 12.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 CA-C-N 116.157 -0.474 . . . . 1.4299999999999999 110.297 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.409 HG22 " H3'" ' C' ' 11' ' ' ' DG' . 81.7 p -84.11 170.03 14.26 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.599 0.714 . . . . 0.81000000000000005 110.572 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' B' ' 6' ' ' LEU . 12.6 mt -77.96 -13.55 59.84 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.201 -0.909 . . . . 0.60999999999999999 109.035 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -66.84 -47.1 73.01 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.173 -0.921 . . . . 1.3200000000000001 110.649 178.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -63.47 -45.12 92.28 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 115.47 -0.786 . . . . 1.9399999999999999 111.698 -179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.422 ' H ' HG23 ' B' ' 9' ' ' VAL . 1.5 t -54.35 -41.64 54.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.263 -0.88 . . . . 1.1399999999999999 110.652 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.73 -46.09 91.75 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.711 -0.677 . . . . 0.71999999999999997 112.058 179.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -62.28 -47.21 85.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.84 -0.164 . . . . 1.8899999999999999 111.219 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 12.5 t80 -57.59 -48.31 79.73 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.535 0.684 . . . . 1.46 110.474 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' B' ' 37' ' ' LYS . . . -71.41 -25.2 62.24 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.712 -1.131 . . . . 0.67000000000000004 113.429 -178.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.35 41.97 12.63 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.323 -0.942 . . . . 1.21 111.901 -178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.34 -175.75 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 109.309 -0.626 . . . . 0.71999999999999997 109.309 -179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 19.4 p -89.99 152.74 21.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.26 0.552 . . . . 1.1000000000000001 111.635 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -49.96 -41.8 47.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.793 -1.094 . . . . 1.49 111.637 178.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -70.3 -45.14 66.89 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.205 -0.452 . . . . 1.4299999999999999 111.824 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.3 m -57.84 -38.38 75.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.912 0.387 . . . . 0.78000000000000003 110.424 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 78.9 t -59.2 -45.11 93.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.863 -0.608 . . . . 1.0800000000000001 110.405 177.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.629 ' O ' HG12 ' B' ' 24' ' ' VAL . 22.8 t -68.59 -38.47 80.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.012 -0.54 . . . . 1.1200000000000001 109.954 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.456 ' HA ' ' ND2' ' B' ' 25' ' ' ASN . 60.0 mtt180 -53.2 -46.19 68.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.802 -0.635 . . . . 1.8799999999999999 110.468 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.27 -43.02 98.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.623 -0.717 . . . . 1.3899999999999999 110.755 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.629 HG12 ' O ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.98 -28.92 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 N-CA-C 112.955 0.724 . . . . 1.3100000000000001 112.955 -178.402 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.456 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 18.1 p30 -85.87 -32.1 21.87 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.013 0.37 . . . . 2.1899999999999999 111.942 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.513 ' HG3' ' H ' ' B' ' 27' ' ' ALA . 7.5 pt20 176.11 -58.4 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.702 -0.851 . . . . 3.2999999999999998 108.702 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.513 ' H ' ' HG3' ' B' ' 26' ' ' GLN . . . 171.09 -62.44 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.566 -1.197 . . . . 3.0800000000000001 108.229 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.444 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 3.0 m 42.8 75.95 0.08 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.654 0.983 . . . . 3.25 113.654 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . 0.537 ' HB3' ' H72' ' D' ' 4' ' ' ' DT' . 50.9 m80 67.52 52.82 0.76 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 112.325 0.491 . . . . 1.75 112.325 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.438 HG23 ' O ' ' B' ' 27' ' ' ALA . 69.8 t -134.67 135.96 52.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.943 -0.572 . . . . 1.3500000000000001 110.968 177.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 49.6 m -74.14 144.77 44.73 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.771 0.67 . . . . 1.5800000000000001 110.5 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -55.19 -44.08 74.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.82 -0.627 . . . . 1.27 112.218 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.55 -39.76 73.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.851 0.358 . . . . 2.2000000000000002 110.603 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 16.0 m -61.05 -45.7 93.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.825 -0.625 . . . . 1.05 112.181 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 13.2 ptp180 -66.05 -31.44 72.33 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 120.405 -0.518 . . . . 1.54 109.864 -179.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.99 -43.06 93.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 109.788 -0.449 . . . . 1.97 109.788 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' B' ' 13' ' ' ALA . 12.6 tptm -58.7 -46.63 86.86 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.59 -0.732 . . . . 2.5 111.217 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.9 m -72.48 -24.63 22.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 112.394 0.516 . . . . 1.3799999999999999 112.394 -179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -61.3 -25.35 67.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 112.148 0.425 . . . . 2.0699999999999998 112.148 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.12 -49.85 14.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.996 0.427 . . . . 0.91000000000000003 110.502 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.55 -43.43 98.88 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.855 -0.611 . . . . 0.72999999999999998 111.441 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 3.9 ptp -55.68 -42.69 75.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.92 -0.582 . . . . 1.3999999999999999 111.86 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -82.18 -41.33 20.5 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 111.819 0.303 . . . . 1.03 111.819 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -34.53 76.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.63 0.604 . . . . 2.1000000000000001 112.63 -178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 88.3 mt -91.25 -14.13 31.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 118.001 0.364 . . . . 0.83999999999999997 111.629 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 67.3 65.94 0.41 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.374 0.606 . . . . 1.5600000000000001 111.197 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -81.0 124.87 29.51 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.257 0.551 . . . . 0.88 111.341 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.529 ' HB ' ' HG3' ' B' ' 3' ' ' PRO . 42.0 mt -121.98 122.2 27.76 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 108.839 -0.8 . . . . 1.6000000000000001 108.839 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -55.96 114.76 2.04 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.567 2.178 . . . . 1.45 112.131 -178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.515 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 45.8 t30 -73.66 95.66 2.37 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.029 -1.1 . . . . 1.0900000000000001 108.029 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.427 ' HA ' ' HD2' ' B' ' 51' ' ' ARG . 25.9 tpt180 -53.85 -32.77 54.19 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.977 -0.556 . . . . 3.3900000000000001 111.489 -178.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 64.5 m -61.49 -48.49 80.88 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.958 -0.564 . . . . 0.82999999999999996 111.488 -179.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.65 -42.35 51.67 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.815 -0.175 . . . . 0.63 111.343 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.423 ' HG2' " C5'" ' C' ' 13' ' ' ' DG' . 96.3 mt-30 -59.44 -41.26 89.2 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.879 0.371 . . . . 1.3300000000000001 111.949 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.8 OUTLIER -74.2 -29.34 61.7 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.142 -0.481 . . . . 3.0299999999999998 110.406 -179.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.829 HD13 HD22 ' A' ' 56' ' ' LEU . 0.6 OUTLIER -76.29 -38.67 55.8 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.401 -0.818 . . . . 1.21 109.766 179.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.35 -3.2 58.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.295 -0.866 . . . . 0.98999999999999999 112.017 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.26 28.81 4.72 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 119.185 -1.483 . . . . 2.0899999999999999 113.997 -177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.43 ' HE2' ' HB3' ' B' ' 59' ' ' LYS . 5.0 mtpt -97.61 47.59 1.02 Allowed 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 118.086 0.943 . . . . 5.9199999999999999 109.481 178.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.422 HE21 " H4'" ' D' ' 10' ' ' ' DT' . 93.6 mt-30 -112.49 86.32 2.34 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.572 -0.74 . . . . 4.8300000000000001 109.447 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.5 -32.1 42.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.977 -0.556 . . . . 6.0899999999999999 110.176 -179.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 21.7 mt . . . . . 0 C--O 1.247 0.935 0 CA-C-N 115.441 -0.799 . . . . 7.79 110.421 179.76 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.414 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.087 0 C3'-C2'-C1' 99.09 -2.579 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.573 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.504 -1.217 0 C3'-C2'-C1' 99.365 -2.382 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.573 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.446 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.51 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.43 -2.335 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.51 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C3'-C2'-C1' 99.342 -2.399 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.466 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.076 0 C3'-C2'-C1' 99.613 -2.205 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.466 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.3 -2.429 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.472 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.472 ' C8 ' H2'' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.066 0 C3'-C2'-C1' 99.21 -2.493 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -1.418 0 C3'-C2'-C1' 99.676 -2.16 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.887 0 O4'-C1'-C2' 103.983 -1.924 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.601 ' C5 ' ' C6 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.42 -1.258 0 C3'-C2'-C1' 99.889 -2.008 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.601 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.424 -1.013 0 C3'-C2'-C1' 99.144 -2.54 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.471 " C2'" ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.455 0.842 0 C3'-C2'-C1' 99.638 -2.187 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.471 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 C3'-C2'-C1' 99.047 -2.609 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.941 0 C3'-C2'-C1' 100.073 -1.876 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . 0.461 H2'' ' C6 ' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.872 0 C3'-C2'-C1' 99.627 -2.195 . . . . 1.6299999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.461 ' C6 ' H2'' ' C' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 C3'-C2'-C1' 99.772 -2.091 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.38 -2.371 . . . . 1.1000000000000001 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.856 0 C3'-C2'-C1' 99.026 -2.624 . . . . 1.2 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.43 H2'' ' C6 ' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.153 0 C3'-C2'-C1' 99.803 -2.069 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.43 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.134 0 C3'-C2'-C1' 99.39 -2.364 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.413 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 C3'-C2'-C1' 99.306 -2.424 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . 0.5 H2'' ' C8 ' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.897 0 O4'-C1'-N19 108.686 1.108 . . . . 2.77 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.568 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.739 0 C3'-C2'-C1' 100.838 -1.33 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.568 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.626 0 C4'-C3'-C2' 102.502 -0.698 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.492 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C4'-C3'-C2' 104.675 1.475 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.537 ' H72' ' HB3' ' B' ' 29' ' ' HIS . . . . . . . . 0 O5'--C5' 1.428 -0.771 0 O4'-C1'-C2' 105.0 -1.0 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.609 " C2'" ' H72' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 C3'-C2'-C1' 104.263 1.117 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.609 ' H72' " C2'" ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.531 0.687 0 O4'-C1'-C2' 107.24 1.036 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.594 H2'' ' C8 ' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.949 0 C1'-O4'-C4' 107.044 -1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.79 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.409 -0.859 0 C1'-O4'-C4' 106.989 -1.937 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.79 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.763 0 C3'-C2'-C1' 101.863 -0.598 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.59 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 100.273 -1.733 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.59 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.971 0 C4'-C3'-C2' 104.304 1.104 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.682 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.424 -0.982 0 C3'-C2'-C1' 104.905 1.575 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.549 " H5'" ' HB3' ' A' ' 50' ' ' ASN . . . . . . . . 0 O4'--C1' 1.408 -0.933 0 C4'-C3'-C2' 104.796 1.596 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.555 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 C3'-C2'-C1' 101.093 -1.148 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.555 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 P--O3' 1.599 -0.657 0 O4'-C1'-C2' 105.131 -0.881 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.497 H2'' ' OP2' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C2'-C3'-O3' 113.03 0.9 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.497 ' OP2' H2'' ' D' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.68 0 N19-C1'-C2' 115.982 1.114 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.453 ' N7 ' ' C2 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.913 0 O4'-C1'-N19 108.668 1.085 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.463 ' C2 ' ' C6 ' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.896 0 O4'-C1'-C2' 104.936 -1.058 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.463 ' C6 ' ' C2 ' ' D' ' 19' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 C4'-C3'-C2' 104.154 0.954 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.539 H2'' ' C5 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.802 0 C3'-C2'-C1' 101.055 -1.175 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.539 ' C5 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 C3'-C2'-C1' 101.714 -0.704 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.655 0.264 . . . . 5.7999999999999998 110.469 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.55 116.86 63.0 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 109.846 -0.428 . . . . 5.3499999999999996 109.846 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.81 114.92 2.36 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 121.731 1.621 . . . . 2.4300000000000002 111.248 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.478 HG21 ' O ' ' A' ' 45' ' ' LEU . 1.4 t -66.34 119.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 N-CA-C 108.528 -0.916 . . . . 1.03 108.528 179.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -93.37 173.87 7.49 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.896 0.379 . . . . 0.76000000000000001 111.398 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 17' ' ' TYR . 1.7 pp -67.96 -19.34 64.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.595 -0.73 . . . . 0.98999999999999999 109.413 179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -78.22 -38.22 43.64 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.336 -0.616 . . . . 1.51 109.336 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -63.49 -56.65 14.4 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.643 0.735 . . . . 1.6699999999999999 109.21 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.1 t -57.58 -40.39 74.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 114.191 -1.368 . . . . 0.70999999999999996 111.531 178.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.76 -46.9 83.88 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.274 -0.421 . . . . 0.68000000000000005 111.71 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' OE1' ' A' ' 11' ' ' GLU . 6.4 tp10 -67.78 -41.58 83.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.647 -0.706 . . . . 2.3999999999999999 111.313 -178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -64.24 -34.42 78.06 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.7 0.762 . . . . 1.47 109.999 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.8 -22.39 50.14 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.774 -1.103 . . . . 0.77000000000000002 111.099 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.15 32.47 52.34 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 111.341 -0.704 . . . . 1.3700000000000001 111.341 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.7 m -137.57 -173.09 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.68 -0.489 . . . . 0.77000000000000002 109.68 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.8 p -73.62 179.95 3.87 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.897 0.379 . . . . 1.3300000000000001 110.993 -179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HB2' HD12 ' A' ' 6' ' ' LEU . 6.9 p90 -94.53 5.61 51.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.526 0.679 . . . . 1.3200000000000001 109.979 -179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 5.6 tp-100 -93.24 -43.16 8.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.677 -0.692 . . . . 1.4399999999999999 111.106 -179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.412 ' HB ' HG11 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -54.33 -35.55 62.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.479 -0.782 . . . . 0.77000000000000002 112.142 -179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.567 ' O ' HG22 ' A' ' 23' ' ' VAL . 6.4 p -82.62 -23.77 8.84 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-O 121.093 0.473 . . . . 1.3799999999999999 110.956 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -81.63 -30.21 32.92 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.495 0.664 . . . . 1.0800000000000001 110.945 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.491 ' NH2' ' N7 ' ' C' ' 5' ' ' ' DG' . 51.0 mtt180 -63.7 -21.94 66.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 2.5499999999999998 112.136 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 20' ' ' VAL . 19.2 m -82.71 -18.07 10.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 120.201 -0.6 . . . . 1.6299999999999999 110.206 -178.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.63 -25.08 7.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.549 0.69 . . . . 1.3799999999999999 110.221 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -103.56 -2.07 27.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.717 -0.674 . . . . 1.6100000000000001 109.269 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 54.76 42.63 31.04 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.001 -0.999 . . . . 3.7000000000000002 109.93 -178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.66 121.19 16.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.623 -0.717 . . . . 2.1000000000000001 111.324 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -81.58 69.63 8.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.796 -0.638 . . . . 1.98 110.168 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -161.2 56.08 0.29 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.373 -0.831 . . . . 1.3799999999999999 110.402 -178.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.408 HG22 HH11 ' A' ' 22' ' ' ARG . 42.4 t -150.21 146.39 16.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.019 -0.537 . . . . 1.1100000000000001 111.029 -178.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.9 m -77.52 137.78 38.82 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.309 -0.626 . . . . 1.3200000000000001 109.309 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -44.73 -49.35 10.59 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.514 0.561 . . . . 1.1299999999999999 112.514 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 19.4 ttmt -55.63 -47.1 77.14 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.268 -0.424 . . . . 1.75 111.919 -178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.423 ' O ' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -74.32 -29.51 61.64 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.128 0.49 . . . . 0.98999999999999999 110.948 -179.048 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 38.5 ttp180 -65.8 -49.56 67.85 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.174 -0.921 . . . . 3.3399999999999999 109.622 -179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.79 -38.4 88.89 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.135 -0.484 . . . . 1.76 111.023 179.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.47 -51.84 68.18 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.881 -0.599 . . . . 1.45 111.694 -179.094 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.442 HG23 HG11 ' A' ' 23' ' ' VAL . 17.5 m -65.34 -41.99 92.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.876 -0.602 . . . . 1.45 111.881 -178.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 29.6 mt-10 -67.82 -31.54 71.46 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.974 0.416 . . . . 1.8700000000000001 110.97 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.07 39.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.344 0.593 . . . . 0.88 110.122 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.66 -35.13 80.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.016 -0.993 . . . . 0.70999999999999996 111.369 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.445 ' HB2' ' CD2' ' A' ' 47' ' ' TYR . 10.2 ptt? -72.51 -31.99 65.79 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.701 -0.227 . . . . 1.47 110.868 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -77.19 -34.93 56.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.95 0.405 . . . . 0.93000000000000005 110.193 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -59.48 -48.18 82.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.232 -0.895 . . . . 1.72 110.387 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.478 ' O ' HG21 ' A' ' 4' ' ' VAL . 62.4 mt -83.54 1.51 41.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.935 -0.575 . . . . 0.98999999999999999 111.496 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 56.74 52.93 8.87 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.562 0.696 . . . . 2.2000000000000002 109.703 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 42' ' ' MET . 2.0 t80 -80.36 125.5 29.99 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.104 -0.953 . . . . 1.23 110.391 -179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tt -115.28 114.08 43.21 Favored Pre-proline 0 N--CA 1.445 -0.693 0 N-CA-C 108.913 -0.773 . . . . 1.8799999999999999 108.913 178.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.33 124.76 16.24 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 122.479 2.119 . . . . 0.83999999999999997 112.223 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.573 HD22 " C5'" ' D' ' 12' ' ' ' DG' . 42.6 t-20 -69.41 104.64 2.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.914 -0.585 . . . . 1.1000000000000001 109.74 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -70.61 -14.12 62.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.926 0.393 . . . . 4.7199999999999998 111.379 -178.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 3.3 m -82.72 -34.78 27.15 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 120.785 0.326 . . . . 0.77000000000000002 110.192 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -79.77 -29.22 40.36 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.075 -0.511 . . . . 0.66000000000000003 111.132 178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 2.2 pt20 -69.63 -25.44 63.94 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.393 -0.367 . . . . 1.46 110.543 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 27.9 mt-30 -88.9 -31.32 18.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.794 -0.817 . . . . 1.45 108.794 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.658 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 9.4 tp -52.88 -39.87 63.01 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.497 -1.229 . . . . 0.78000000000000003 111.762 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.59 9.42 0.26 Allowed 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 113.407 0.891 . . . . 1.0800000000000001 113.407 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 109.17 43.26 1.2 Allowed Glycine 0 C--N 1.336 0.579 0 C-N-CA 120.933 -0.651 . . . . 1.6599999999999999 113.698 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.661 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 94.4 mttt -141.04 12.62 2.22 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.47 -0.429 . . . . 4.79 111.54 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.461 ' HB3' ' HB3' ' B' ' 2' ' ' LYS . 23.4 mp0 -56.83 -34.03 67.34 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.053 0.454 . . . . 2.3399999999999999 111.548 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' B' ' 2' ' ' LYS . 73.9 m -85.14 34.49 0.56 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.805 -0.634 . . . . 3.8599999999999999 110.923 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 62' ' ' LEU . 11.3 tp . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.232 -0.89 . . . . 6.96 109.536 -179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.776 0.322 . . . . 6.9199999999999999 110.726 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 60' ' ' GLN . 2.1 pttm -153.51 70.8 6.76 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.293 -0.412 . . . . 6.4199999999999999 110.751 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -92.18 -151.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 122.832 2.355 . . . . 2.1000000000000001 112.732 -178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.407 ' H ' HG12 ' B' ' 4' ' ' VAL . 4.3 p -92.64 144.2 9.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 N-CA-C 108.609 -0.886 . . . . 1.4299999999999999 108.609 178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.513 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 39.6 p -76.69 162.53 27.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.339 0.59 . . . . 0.81000000000000005 111.593 -178.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' B' ' 6' ' ' LEU . 11.0 mt -74.93 -18.54 60.39 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.366 -0.975 . . . . 0.60999999999999999 108.366 178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -69.07 -40.53 78.44 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.312 -0.858 . . . . 1.3200000000000001 109.501 177.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.82 -36.14 82.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.157 -0.929 . . . . 1.9399999999999999 109.761 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 92.5 t -68.48 -44.34 83.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.337 -0.847 . . . . 1.1399999999999999 109.956 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.29 -48.26 74.34 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.63 -0.714 . . . . 0.71999999999999997 111.401 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -62.59 -39.07 92.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.629 -0.714 . . . . 1.8899999999999999 111.401 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -65.32 -43.87 89.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.289 0.566 . . . . 1.46 111.042 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.36 -23.48 61.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.906 -1.043 . . . . 0.67000000000000004 112.305 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.42 44.26 28.09 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.205 -0.997 . . . . 1.21 112.175 -179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.459 HG11 HG23 ' B' ' 34' ' ' THR . 3.4 m -146.63 167.76 6.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.648 -0.501 . . . . 0.71999999999999997 109.648 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -71.76 148.14 46.62 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.24 0.543 . . . . 1.1000000000000001 111.945 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -49.64 -43.69 47.06 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.863 0.865 . . . . 1.49 112.078 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.67 -38.65 82.08 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.055 0.455 . . . . 1.4299999999999999 111.262 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.427 HG23 ' NH1' ' B' ' 22' ' ' ARG . 0.2 OUTLIER -66.4 -36.24 82.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.062 0.458 . . . . 0.78000000000000003 110.483 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.568 ' O ' HG12 ' B' ' 23' ' ' VAL . 24.6 t -62.2 -50.02 81.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.647 -0.706 . . . . 1.0800000000000001 110.456 178.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 6.5 t -66.71 -32.11 73.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.341 0.591 . . . . 1.1200000000000001 109.456 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.446 ' CZ ' ' H72' ' D' ' 4' ' ' ' DT' . 17.3 ttm180 -54.02 -38.9 65.63 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.795 -0.639 . . . . 1.8799999999999999 111.594 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.568 HG12 ' O ' ' B' ' 20' ' ' VAL . 4.4 p -80.9 -28.98 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-O 121.253 0.549 . . . . 1.3899999999999999 109.922 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.47 -49.55 52.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 CA-C-N 116.024 -0.534 . . . . 1.3100000000000001 110.494 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . 0.427 ' ND2' ' HA ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -85.63 10.21 13.97 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.439 -0.801 . . . . 2.1899999999999999 110.376 179.724 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 39.45 51.65 2.21 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.241 1.017 . . . . 3.2999999999999998 112.19 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.37 6.55 9.81 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.456 -0.793 . . . . 3.0800000000000001 111.963 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 4.3 t 66.83 -171.21 0.19 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.754 -0.462 . . . . 3.25 109.754 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 45.4 m80 62.59 27.42 16.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 1.75 110.371 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.03 109.39 28.07 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 109.638 -0.505 . . . . 1.3500000000000001 109.638 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 36.6 t -57.08 148.44 21.74 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.013 -0.539 . . . . 1.5800000000000001 110.543 179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.31 -44.64 72.19 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.392 0.615 . . . . 1.27 109.794 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -59.69 -38.64 82.12 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.807 -1.088 . . . . 2.2000000000000002 111.829 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.459 HG23 HG11 ' B' ' 15' ' ' VAL . 22.6 m -63.38 -43.33 97.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.083 0.468 . . . . 1.05 110.367 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -42.97 94.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.759 -0.655 . . . . 1.54 110.899 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -51.47 -46.44 63.11 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.647 0.736 . . . . 1.97 109.97 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -67.54 -60.68 2.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.113 -0.949 . . . . 2.5 111.923 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.1 t -54.38 -40.89 50.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 112.949 0.722 . . . . 1.3799999999999999 112.949 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.35 -36.68 78.57 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.425 -0.51 . . . . 2.0699999999999998 110.418 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.62 -55.78 18.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.091 -0.504 . . . . 0.91000000000000003 109.899 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.13 70.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.277 -0.419 . . . . 0.72999999999999998 111.914 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 2.8 mtm -52.64 -48.5 66.36 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.938 0.347 . . . . 1.3999999999999999 111.938 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.85 -37.56 34.7 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.1 0.408 . . . . 1.03 112.1 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -67.52 -33.52 75.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.181 -0.463 . . . . 2.1000000000000001 112.212 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.35 -17.13 17.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 119.627 -0.225 . . . . 0.83999999999999997 111.427 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.16 62.84 0.57 Allowed 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 121.131 0.491 . . . . 1.5600000000000001 110.217 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -76.73 129.31 36.14 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 115.72 -0.673 . . . . 0.88 109.773 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 74.4 mt -127.21 113.97 21.59 Favored Pre-proline 0 N--CA 1.44 -0.97 0 N-CA-C 108.565 -0.902 . . . . 1.6000000000000001 108.565 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 116.38 2.12 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.541 2.161 . . . . 1.45 111.885 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.705 ' O ' ' HG2' ' B' ' 54' ' ' GLN . 20.5 t30 -77.65 98.69 5.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.18 -0.918 . . . . 1.0900000000000001 109.21 -179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.429 ' O ' ' HD3' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -51.33 -29.07 13.94 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.228 -0.442 . . . . 3.3900000000000001 111.235 -177.796 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.496 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 60.0 m -62.98 -50.19 71.73 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-N 116.118 -0.492 . . . . 0.82999999999999996 110.683 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -74.15 -37.02 64.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.647 -0.251 . . . . 0.63 111.566 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.705 ' HG2' ' O ' ' B' ' 50' ' ' ASN . 2.5 mm100 -59.31 -52.87 63.79 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.067 0.46 . . . . 1.3300000000000001 110.672 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.518 ' HA ' ' O ' ' B' ' 59' ' ' LYS . 0.3 OUTLIER -65.61 -28.2 68.96 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.007 -0.542 . . . . 3.0299999999999998 111.676 -178.405 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.624 HD13 HD22 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -75.04 -34.58 61.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.543 0.687 . . . . 1.21 109.332 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.23 -3.05 18.19 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.868 -1.06 . . . . 0.98999999999999999 112.519 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 119.48 15.92 5.28 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.647 -1.263 . . . . 2.0899999999999999 113.469 178.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.518 ' O ' ' HA ' ' B' ' 55' ' ' GLN . 22.9 mttp -104.91 86.68 2.5 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.295 -1.002 . . . . 5.9199999999999999 108.295 179.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -153.7 128.91 9.72 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.262 -0.881 . . . . 4.8300000000000001 110.922 -176.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -81.47 -18.53 44.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.832 -0.622 . . . . 6.0899999999999999 111.575 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 68.6 mt . . . . . 0 C--O 1.247 0.967 0 CA-C-N 115.629 -0.714 . . . . 7.79 111.536 179.423 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.03 0 C3'-C2'-C1' 99.33 -2.407 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.609 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 C3'-C2'-C1' 99.399 -2.358 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.609 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-C2' 103.685 -2.196 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.498 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.966 0 C3'-C2'-C1' 99.366 -2.382 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.498 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.929 0 C3'-C2'-C1' 98.908 -2.708 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.495 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.768 0 O4'-C1'-C2' 104.027 -1.884 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.495 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.92 0 C3'-C2'-C1' 99.869 -2.022 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.811 0 C3'-C2'-C1' 99.262 -2.456 . . . . 1.0700000000000001 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.889 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.179 0 C3'-C2'-C1' 99.602 -2.213 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.504 -1.238 0 C3'-C2'-C1' 100.12 -1.843 . . . . 1.05 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.578 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.942 -1.97 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.513 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.503 -1.291 0 C3'-C2'-C1' 98.266 -3.167 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.491 ' C8 ' ' H72' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.77 0 C3'-C2'-C1' 99.781 -2.085 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.491 ' H72' ' C8 ' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.039 0 C3'-C2'-C1' 98.774 -2.804 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.412 ' OP2' " H2'" ' C' ' 15' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.455 0.801 0 C3'-C2'-C1' 99.505 -2.282 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 C3'-C2'-C1' 100.042 -1.899 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.52 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.947 0 C3'-C2'-C1' 99.661 -2.171 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.52 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.508 -0.931 0 C3'-C2'-C1' 98.959 -2.672 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.635 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 P--O3' 1.596 -0.945 0 C3'-C2'-C1' 99.294 -2.433 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.635 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.82 0 C3'-C2'-C1' 99.353 -2.39 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.43 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 C3'-C2'-C1' 98.866 -2.738 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.43 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.507 -1.02 0 C3'-C2'-C1' 99.277 -2.445 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 C3'-C2'-C1' 100.923 -1.269 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.624 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 100.272 -1.734 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.624 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.701 0 C1'-O4'-C4' 110.676 0.697 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.513 H2'' ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.535 0.657 0 C3'-C2'-C1' 105.403 1.931 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.513 ' C6 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 P--O3' 1.623 1.306 0 C4'-C3'-C2' 104.416 1.216 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O4'-C1'-C2' 106.665 0.514 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.907 0 N19-C1'-C2' 115.818 1.011 . . . . 1.26 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.924 0 C3'-C2'-C1' 104.848 1.534 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.874 0 C3'-C2'-C1' 105.238 1.813 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.555 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C1'-N19 108.294 0.618 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.504 H2'' " O5'" ' D' ' 11' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 N19-C1'-C2' 116.1 1.188 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.504 " O5'" H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.865 0 C3'-C2'-C1' 101.528 -0.837 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.658 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C1' 1.405 -1.116 0 C1'-O4'-C4' 107.737 -1.402 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.426 ' C4 ' ' C5 ' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.409 -0.851 0 C1'-O4'-C4' 107.221 -1.771 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.503 H2'' ' C5 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C4'-C3'-C2' 104.624 1.424 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.503 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.441 0.75 0 C3'-C2'-C1' 105.564 2.046 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.593 " H1'" ' C6 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.622 1.22 0 C3'-C2'-C1' 104.999 1.642 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.593 ' C6 ' " H1'" ' D' ' 16' ' ' ' DA' . . . . . . . . 0 P--O3' 1.624 1.382 0 C5'-C4'-C3' 116.806 1.404 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.751 0 C5'-C4'-O4' 108.116 -0.803 . . . . 1.5600000000000001 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.608 0 N19-C1'-C2' 116.239 1.275 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.41 -0.739 0 C4'-C3'-C2' 103.966 0.766 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.437 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.841 0 N19-C1'-C2' 115.25 0.656 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.437 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.816 0 C3'-C2'-C1' 101.473 -0.876 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.6 mmt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.207 -0.294 . . . . 5.7999999999999998 110.207 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -97.25 112.46 61.0 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.39 -0.368 . . . . 5.3499999999999996 110.674 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -67.25 102.37 0.68 Allowed 'Trans proline' 0 C--O 1.239 0.533 0 C-N-CA 122.334 2.023 . . . . 2.4300000000000002 111.934 179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -88.4 115.69 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.481 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.021 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.3 p -96.12 -179.12 4.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 116.26 -0.427 . . . . 0.76000000000000001 110.271 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.6 ' HG ' ' OP2' ' D' ' 13' ' ' ' DC' . 0.3 OUTLIER -69.91 -24.08 63.33 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 123.232 0.333 . . . . 0.98999999999999999 111.027 -179.408 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -68.24 -32.46 72.67 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 109.203 -0.666 . . . . 1.51 109.203 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.66 -58.6 5.87 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.289 -0.869 . . . . 1.6699999999999999 110.02 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.441 ' H ' HG23 ' A' ' 9' ' ' VAL . 2.7 t -57.1 -40.79 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.70999999999999996 109.13 177.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.72 -50.12 66.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 123.775 0.672 . . . . 0.68000000000000005 110.465 179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -66.15 -40.38 90.52 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 123.421 0.451 . . . . 2.3999999999999999 110.799 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.7 t80 -64.7 -50.65 66.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.471 0.653 . . . . 1.47 110.932 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' HB3' HG22 ' A' ' 15' ' ' VAL . . . -71.76 -23.51 61.6 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.977 -1.01 . . . . 0.77000000000000002 111.945 -178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.11 40.84 10.92 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.898 -0.881 . . . . 1.3700000000000001 110.898 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.468 HG22 ' HB3' ' A' ' 13' ' ' ALA . 3.9 m -140.93 -171.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 123.533 0.733 . . . . 0.77000000000000002 110.047 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.4 ' CB ' " H2'" ' C' ' 5' ' ' ' DG' . 72.9 p -88.3 -167.76 1.98 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.693 -0.685 . . . . 1.3300000000000001 110.499 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.416 ' HB2' HD22 ' A' ' 6' ' ' LEU . 13.5 p90 -98.35 1.32 46.87 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.476 0.655 . . . . 1.3200000000000001 110.508 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -94.62 -30.96 14.07 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.285 -0.87 . . . . 1.4399999999999999 110.087 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 23' ' ' VAL . 0.3 OUTLIER -63.85 -43.64 95.55 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.736 -0.665 . . . . 0.77000000000000002 111.126 -179.404 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 m -80.11 -22.29 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 115.859 -0.61 . . . . 1.3799999999999999 110.876 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.434 ' HA ' HG22 ' A' ' 24' ' ' VAL . 0.9 OUTLIER -81.33 -24.22 37.27 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.442 0.639 . . . . 1.0800000000000001 110.593 -179.483 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.453 HH22 " H2'" ' C' ' 4' ' ' ' DT' . 3.8 ttp180 -76.57 -22.03 54.84 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 2.5499999999999998 110.328 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 19' ' ' THR . 43.6 t -89.57 -37.34 9.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 115.444 -0.798 . . . . 1.6299999999999999 111.503 -178.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 21' ' ' SER . 6.4 m -62.89 -27.05 42.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 CA-C-O 121.331 0.586 . . . . 1.3799999999999999 111.044 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -101.17 10.72 40.55 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.35 0.595 . . . . 1.6100000000000001 110.44 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 46.26 46.49 13.41 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 114.975 -1.011 . . . . 3.7000000000000002 112.647 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -79.15 139.67 37.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.121 0.486 . . . . 2.1000000000000001 110.75 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.4 m -84.44 59.86 5.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.804 -0.634 . . . . 1.98 111.075 -179.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.65 54.6 0.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.993 -0.549 . . . . 1.3799999999999999 110.044 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.9 t -152.34 141.18 14.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 114.949 -1.023 . . . . 1.1100000000000001 109.813 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.515 ' HB2' ' OG1' ' A' ' 34' ' ' THR . 24.1 m -68.08 141.22 56.21 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 115.915 -0.584 . . . . 1.3200000000000001 109.487 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . -49.64 -48.04 49.5 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.162 0.43 . . . . 1.1299999999999999 112.162 -178.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -56.78 -50.08 73.38 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.95 -0.568 . . . . 1.75 110.756 179.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 31' ' ' SER . 0.3 OUTLIER -62.7 -38.63 91.18 Favored 'General case' 0 N--CA 1.446 -0.65 0 O-C-N 123.252 0.345 . . . . 0.98999999999999999 110.704 -179.343 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttt85 -58.62 -51.25 70.7 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.422 0.154 . . . . 3.3399999999999999 110.757 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 32' ' ' ALA . 24.4 mt-10 -59.3 -39.35 82.75 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.14 0.495 . . . . 1.76 110.306 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -60.28 -55.63 31.38 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.693 -0.685 . . . . 1.45 111.479 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' THR . 55.5 t -50.66 -45.87 27.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 114.172 -1.376 . . . . 1.45 111.123 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.19 -53.31 51.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.824 -0.626 . . . . 1.8700000000000001 110.646 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.9 83.28 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.142 -0.481 . . . . 0.88 110.968 -179.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.7 -42.69 77.4 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.994 0.426 . . . . 0.70999999999999996 111.982 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.3 ptp -69.68 -25.43 63.88 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.264 -0.426 . . . . 1.47 110.701 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.11 -34.2 50.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.086 -0.506 . . . . 0.93000000000000005 110.5 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.67 -37.22 82.06 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.532 0.682 . . . . 1.72 111.254 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.7 mt -95.26 -7.86 37.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.98999999999999999 112.008 -179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m120 59.06 49.77 9.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.701 0.762 . . . . 2.2000000000000002 109.918 -178.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 19.1 t80 -85.19 124.81 32.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.724 0.774 . . . . 1.23 112.266 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 8.4 pt -113.85 121.98 35.84 Favored Pre-proline 0 C--N 1.311 -1.076 0 N-CA-C 108.423 -0.954 . . . . 1.8799999999999999 108.423 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.76 125.05 16.26 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.243 1.962 . . . . 0.83999999999999997 111.725 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 52' ' ' CYS . 52.6 t-20 -71.61 99.88 2.17 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-O 121.088 0.47 . . . . 1.1000000000000001 109.77 -179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.477 ' HA ' ' HG2' ' A' ' 54' ' ' GLN . 22.4 mmt180 -67.38 -14.74 63.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.83 -0.623 . . . . 4.7199999999999998 111.55 -178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.461 ' HB2' ' OD1' ' A' ' 50' ' ' ASN . 1.3 m -76.63 -37.85 55.68 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.737 -0.468 . . . . 0.77000000000000002 109.737 -178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.659 ' HA ' HD11 ' B' ' 56' ' ' LEU . . . -80.69 -27.23 37.08 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.693 -0.685 . . . . 0.66000000000000003 110.654 177.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.477 ' HG2' ' HA ' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -67.74 -29.55 68.81 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 116.147 -0.479 . . . . 1.46 111.385 -178.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.515 ' HB3' ' HA ' ' A' ' 60' ' ' GLN . 89.3 mt-30 -86.41 -16.9 35.79 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 121.626 0.727 . . . . 1.45 109.836 -179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.48 HD21 ' N3 ' ' C' ' 11' ' ' ' DG' . 0.9 OUTLIER -71.82 -39.52 69.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.896 -1.047 . . . . 0.78000000000000003 109.487 -179.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.8 -4.05 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.854 -0.612 . . . . 1.0800000000000001 110.614 179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -133.31 -113.61 1.44 Allowed Glycine 0 N--CA 1.437 -1.243 0 N-CA-C 109.454 -1.458 . . . . 1.6599999999999999 109.454 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.61 143.1 48.42 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.528 0.664 . . . . 4.79 110.494 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 7.2 mp0 -73.46 -67.17 0.61 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.701 -0.851 . . . . 2.3399999999999999 108.701 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.4 m -146.86 16.66 1.24 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.255 -1.016 . . . . 3.8599999999999999 108.255 178.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 49.0 tp . . . . . 0 C--O 1.239 0.511 0 CA-C-N 115.389 -0.823 . . . . 6.96 111.048 179.809 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.598 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 65.0 mtt . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 109.769 -0.456 . . . . 6.9199999999999999 109.769 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -103.62 94.87 6.56 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.743 -0.466 . . . . 6.4199999999999999 109.743 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.598 ' HD3' ' O ' ' B' ' 1' ' ' MET . 56.5 Cg_endo -100.2 132.72 0.18 Allowed 'Trans proline' 0 N--CA 1.441 -1.596 0 C-N-CA 123.276 2.651 . . . . 2.1000000000000001 113.032 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 47' ' ' TYR . 35.6 m -83.54 150.22 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 N-CA-C 109.209 -0.663 . . . . 1.4299999999999999 109.209 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 21.0 p -79.44 162.03 25.74 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.945 0.879 . . . . 0.81000000000000005 111.399 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.417 ' HB2' ' CE1' ' B' ' 17' ' ' TYR . 17.0 mt -72.59 -14.73 61.69 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.419 -1.264 . . . . 0.60999999999999999 108.776 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -72.09 -50.18 30.23 Favored 'General case' 0 C--N 1.342 0.253 0 N-CA-C 108.546 -0.909 . . . . 1.3200000000000001 108.546 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.75 -48.66 80.42 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.527 -0.761 . . . . 1.9399999999999999 109.744 178.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.75 -43.15 83.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 114.766 -1.106 . . . . 1.1399999999999999 111.583 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.7 -41.37 81.53 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.095 -0.502 . . . . 0.71999999999999997 111.912 -179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -67.69 -44.03 78.74 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 123.984 0.803 . . . . 1.8899999999999999 110.953 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.426 ' HB2' HD11 ' B' ' 45' ' ' LEU . 24.8 t80 -62.8 -37.04 85.13 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.581 0.705 . . . . 1.46 111.015 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' B' ' 38' ' ' VAL . . . -78.11 -20.33 52.37 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.758 -0.655 . . . . 0.67000000000000004 111.433 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.0 40.56 24.88 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 120.547 -0.835 . . . . 1.21 112.645 -179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 33.1 m -140.31 -165.45 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 109.9 -0.407 . . . . 0.71999999999999997 109.9 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 82.4 p -102.54 161.35 13.79 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 110.048 -0.352 . . . . 1.1000000000000001 110.048 177.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.417 ' CE1' ' HB2' ' B' ' 6' ' ' LEU . 66.3 t80 -55.03 -38.15 67.57 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 113.295 0.85 . . . . 1.49 113.295 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -66.35 -51.19 59.68 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 112.336 0.495 . . . . 1.4299999999999999 112.336 -178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.407 ' HA ' ' HB2' ' B' ' 22' ' ' ARG . 0.0 OUTLIER -56.24 -29.9 61.67 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.038 0.447 . . . . 0.78000000000000003 111.072 -179.346 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.18 -48.31 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.558 -0.747 . . . . 1.0800000000000001 110.506 177.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 7.9 t -76.75 -29.74 56.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.016 0.436 . . . . 1.1200000000000001 110.751 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.407 ' HB2' ' HA ' ' B' ' 19' ' ' THR . 62.1 mtt-85 -52.27 -40.12 61.33 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.634 -0.712 . . . . 1.8799999999999999 111.802 178.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.701 HG11 HG21 ' B' ' 38' ' ' VAL . 10.9 p -78.02 -37.81 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.32 -0.622 . . . . 1.3899999999999999 109.32 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 9.2 t -59.19 -51.96 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.575 -0.739 . . . . 1.3100000000000001 110.783 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -90.15 9.02 29.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 2.1899999999999999 110.794 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 41.15 51.57 3.42 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.149 -1.387 . . . . 3.2999999999999998 111.717 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -72.96 6.63 2.5 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.059 -0.973 . . . . 3.0800000000000001 112.313 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 6.7 m 62.31 176.22 0.13 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.221 0.534 . . . . 3.25 110.504 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 31.0 m80 66.38 34.82 6.08 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.546 -0.752 . . . . 1.75 110.131 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 11.0 t -120.23 114.81 45.23 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.294 0 CA-C-N 115.268 -0.878 . . . . 1.3500000000000001 109.859 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -58.26 147.81 29.4 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.077 0.465 . . . . 1.5800000000000001 111.212 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.23 -39.12 72.03 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.249 -0.432 . . . . 1.27 109.859 178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' B' ' 37' ' ' LYS . 19.6 mmtp -60.59 -41.63 95.11 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.813 -0.63 . . . . 2.2000000000000002 111.068 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -67.15 -48.5 67.86 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 112.69 0.626 . . . . 1.05 112.69 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -62.3 -28.98 70.11 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.468 -0.493 . . . . 1.54 110.065 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -69.45 -41.84 75.7 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.132 -0.485 . . . . 1.97 109.931 178.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' B' ' 33' ' ' LYS . 26.0 mtpt -58.52 -56.53 20.94 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.003 0.43 . . . . 2.5 110.482 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.701 HG21 HG11 ' B' ' 23' ' ' VAL . 5.6 m -60.72 -34.12 57.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.529 0.566 . . . . 1.3799999999999999 112.529 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.41 -33.77 74.26 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.202 -0.296 . . . . 2.0699999999999998 110.202 -179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -63.66 -56.05 18.76 Favored 'General case' 0 N--CA 1.443 -0.783 0 C-N-CA 120.337 -0.545 . . . . 0.91000000000000003 109.88 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.57 -44.43 80.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 112.163 0.431 . . . . 0.72999999999999998 112.163 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' B' ' 43' ' ' ALA . 1.4 ptp -54.65 -44.55 73.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.341 0.497 . . . . 1.3999999999999999 112.341 -178.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . 0.461 ' N ' ' HG3' ' B' ' 42' ' ' MET . . . -85.95 -39.06 17.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.469 -0.492 . . . . 1.03 111.386 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 1.5 tp10 -65.15 -39.91 93.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.232 0.539 . . . . 2.1000000000000001 111.947 -178.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 12' ' ' TYR . 62.9 mt -95.03 -10.22 31.49 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.909 -0.587 . . . . 0.83999999999999997 111.182 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.75 63.83 0.32 Allowed 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 112.411 0.523 . . . . 1.5600000000000001 112.411 178.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.451 ' HA ' HG22 ' B' ' 4' ' ' VAL . 28.3 t80 -76.49 120.98 22.46 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.245 0.545 . . . . 0.88 110.65 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 21.8 mm -113.67 124.5 31.06 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 108.11 -1.07 . . . . 1.6000000000000001 108.11 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -61.57 108.78 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 121.926 1.751 . . . . 1.45 111.223 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.559 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 53.3 t-20 -68.66 95.45 0.66 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.66 -1.155 . . . . 1.0900000000000001 109.1 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 22.5 tpp180 -55.32 -28.14 51.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.127 -0.488 . . . . 3.3900000000000001 110.441 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.559 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 65.7 m -70.83 -48.79 52.14 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.787 -0.642 . . . . 0.82999999999999996 110.452 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.18 -42.98 75.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.547 -0.297 . . . . 0.63 110.711 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -59.73 -42.76 93.87 Favored 'General case' 0 C--O 1.239 0.513 0 O-C-N 123.144 0.277 . . . . 1.3300000000000001 111.231 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' B' ' 52' ' ' CYS . 0.0 OUTLIER -64.38 -40.63 96.19 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.598 0.713 . . . . 3.0299999999999998 109.239 178.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 53' ' ' ALA . 0.3 OUTLIER -67.57 -36.4 80.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.511 -1.222 . . . . 1.21 111.708 -179.571 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.78 -3.62 7.19 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.638 0.607 . . . . 0.98999999999999999 112.638 -178.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 131.56 25.97 0.75 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 119.813 -1.184 . . . . 2.0899999999999999 114.379 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -125.54 96.25 4.74 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 117.906 0.853 . . . . 5.9199999999999999 109.92 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 72.8 mm-40 -72.29 107.6 4.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.167 -0.924 . . . . 4.8300000000000001 110.807 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -96.95 -51.54 4.21 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.517 -0.765 . . . . 6.0899999999999999 112.077 -178.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' B' ' 62' ' ' LEU . 1.4 mm? . . . . . 0 C--O 1.252 1.23 0 O-C-N 124.105 0.878 . . . . 7.79 109.634 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.449 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.746 0 C3'-C2'-C1' 99.5 -2.286 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.552 H2'' ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.451 0 O4'-C1'-C2' 103.695 -2.186 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.552 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 P--O3' 1.598 -0.716 0 O4'-C1'-C2' 103.544 -2.324 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.754 H2'' ' H71' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C1'-C2' 103.763 -2.125 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.754 ' H71' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.419 -1.283 0 C3'-C2'-C1' 98.968 -2.665 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.456 ' C8 ' H2'' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 100.127 -1.838 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.517 H2'' ' C8 ' ' C' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.814 0 C3'-C2'-C1' 99.607 -2.209 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.517 ' C8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.312 0 C3'-C2'-C1' 99.515 -2.275 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.514 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.105 0 O4'-C1'-C2' 103.905 -1.995 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.514 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.501 -1.424 0 C3'-C2'-C1' 98.798 -2.787 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.507 ' C4 ' ' C4 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 P--O3' 1.594 -1.064 0 C3'-C2'-C1' 99.363 -2.384 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.515 ' N2 ' ' HB3' ' B' ' 56' ' ' LEU . . . . . . . . 0 P--O3' 1.616 0.729 0 C3'-C2'-C1' 99.454 -2.319 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.454 ' C6 ' ' C6 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.503 -1.275 0 C3'-C2'-C1' 98.505 -2.996 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.4 " C2'" ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.452 0.57 0 C3'-C2'-C1' 99.877 -2.016 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.4 ' H71' " C2'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.791 0 C3'-C2'-C1' 99.325 -2.411 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.003 0 O4'-C1'-C2' 103.872 -2.026 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.037 0 C3'-C2'-C1' 99.218 -2.487 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.516 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -0.986 0 C3'-C2'-C1' 99.858 -2.03 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.516 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 98.747 -2.823 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.479 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.048 0 C3'-C2'-C1' 99.509 -2.279 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.445 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.822 0 O4'-C1'-C2' 103.661 -2.217 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.443 ' C6 ' H2'' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.792 0 C3'-C2'-C1' 99.37 -2.378 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.353 0 C3'-C2'-C1' 99.198 -2.501 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 N19-C1'-C2' 116.036 1.147 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.823 H2'' ' N7 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.747 0 C3'-C2'-C1' 99.608 -2.209 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.823 ' N7 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.732 0 C3'-C2'-C1' 104.657 1.398 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.537 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.41 -0.79 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.537 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C4'-C3' 106.435 0.835 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.765 H2'' ' H71' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -1.021 0 O4'-C1'-C2' 107.078 0.89 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.765 ' H71' H2'' ' D' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.534 0.938 0 C3'-C2'-C1' 104.842 1.53 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.692 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.529 1.053 0 C3'-C2'-C1' 105.183 1.774 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 C1'-O4'-C4' 107.499 -1.572 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.516 " H1'" " H5'" ' D' ' 10' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.897 0 C4'-C3'-C2' 104.471 1.271 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.516 " H5'" " H1'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.444 1.027 0 C3'-C2'-C1' 105.922 2.301 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.622 1.252 0 P-O3'-C3' 120.966 1.055 . . . . 1.96 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.479 " H1'" " O4'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.424 -1.018 0 C3'-C2'-C1' 105.026 1.662 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.6 ' OP2' ' HG ' ' A' ' 6' ' ' LEU . . . . . . . . 0 P--O3' 1.596 -0.913 0 C1'-O4'-C4' 106.707 -2.138 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.593 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.814 0 C4'-C3'-C2' 104.592 1.392 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.57 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 C3'-C2'-C1' 104.685 1.418 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.501 ' C8 ' " C2'" ' D' ' 15' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 C3'-C2'-C1' 101.181 -1.085 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.525 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.008 0 C3'-C2'-C1' 99.68 -2.157 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.525 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 C5'-C4'-O4' 108.253 -0.717 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.402 ' OP2' H2'' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-C2' 104.623 -1.342 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.694 0 C4'-C3'-C2' 104.216 1.016 . . . . 1.6899999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.56 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 P-O5'-C5' 119.825 -0.672 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.56 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.827 0 N19-C1'-C2' 115.437 0.773 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttt . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.612 0.244 . . . . 5.7999999999999998 111.108 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' HB3' HG23 ' A' ' 4' ' ' VAL . 23.6 mmtt -140.07 135.69 16.54 Favored Pre-proline 0 C--O 1.235 0.304 0 N-CA-C 109.721 -0.474 . . . . 5.3499999999999996 109.721 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -84.63 47.51 2.17 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.829 2.353 . . . . 2.4300000000000002 112.073 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 2' ' ' LYS . 3.8 t -106.73 105.96 19.73 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.951 0 N-CA-C 108.632 -0.877 . . . . 1.03 108.632 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.477 ' O ' HG23 ' A' ' 9' ' ' VAL . 50.2 p -92.71 178.2 5.87 Favored 'General case' 0 C--N 1.315 -0.91 0 O-C-N 124.072 0.857 . . . . 0.76000000000000001 109.317 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.455 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 2.2 pp -63.72 -19.35 64.87 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.91 -0.316 . . . . 0.98999999999999999 110.645 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -75.97 -35.58 59.59 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.986 -0.746 . . . . 1.51 108.986 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -72.27 -50.8 24.36 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.13 -0.486 . . . . 1.6699999999999999 110.457 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 5' ' ' THR . 3.6 t -54.39 -32.1 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 121.145 0.498 . . . . 0.70999999999999996 110.292 178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.53 -45.81 92.47 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.68000000000000005 111.015 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -66.46 -44.16 83.5 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.799 -0.637 . . . . 2.3999999999999999 110.804 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -64.92 -34.89 79.48 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.893 -0.594 . . . . 1.47 111.085 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.31 -24.87 34.42 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.151 -0.477 . . . . 0.77000000000000002 111.55 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.68 40.98 8.52 Favored Glycine 0 C--N 1.317 -0.503 0 C-N-CA 120.927 -0.654 . . . . 1.3700000000000001 112.073 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.2 m -149.18 -176.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.358 -0.608 . . . . 0.77000000000000002 109.358 -178.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 94.6 p -75.33 -169.65 1.03 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 109.724 -0.472 . . . . 1.3300000000000001 109.724 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.455 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 15.3 p90 -97.11 2.7 51.51 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.257 0.551 . . . . 1.3200000000000001 110.203 -178.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -93.67 -30.93 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.722 -0.672 . . . . 1.4399999999999999 110.554 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -38.07 74.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.337 -0.847 . . . . 0.77000000000000002 110.802 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.604 ' O ' HG22 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -78.39 -57.3 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 N-CA-C 112.413 0.523 . . . . 1.3799999999999999 112.413 179.041 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.6 t -57.44 -24.17 53.99 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.321 0.86 . . . . 1.0800000000000001 113.321 -178.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.48 ' HE ' ' CG2' ' A' ' 30' ' ' VAL . 18.1 ttp180 -74.11 -27.36 60.84 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.477 -0.139 . . . . 2.5499999999999998 111.128 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.604 HG22 ' O ' ' A' ' 20' ' ' VAL . 23.8 m -87.35 -17.62 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.537 0.684 . . . . 1.6299999999999999 110.086 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 20' ' ' VAL . 61.6 t -74.04 -21.11 17.8 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 115.146 -0.934 . . . . 1.3799999999999999 111.881 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.552 HD21 ' P ' ' D' ' 14' ' ' ' DT' . 50.7 m-80 -124.61 -43.26 2.03 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.037 0.755 . . . . 1.6100000000000001 113.037 -178.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' A' ' 27' ' ' ALA . 5.8 mp0 -124.69 -80.07 0.62 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 110.442 -0.207 . . . . 3.7000000000000002 110.442 -179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB2' ' HA ' ' A' ' 23' ' ' VAL . . . 100.16 12.11 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 125.083 1.489 . . . . 2.1000000000000001 110.036 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 29' ' ' HIS . 0.7 OUTLIER -78.17 143.45 37.21 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.452 -0.794 . . . . 1.98 109.358 178.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 28' ' ' SER . 0.2 OUTLIER 69.8 52.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.221 0.534 . . . . 1.3799999999999999 109.857 -178.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.48 ' CG2' ' HE ' ' A' ' 22' ' ' ARG . 41.1 t -149.84 139.23 15.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 115.096 -0.956 . . . . 1.1100000000000001 109.423 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 t -81.05 144.46 31.73 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.638 -0.71 . . . . 1.3200000000000001 109.923 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.0 -40.23 43.78 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.561 -0.745 . . . . 1.1299999999999999 112.045 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -55.54 -54.01 49.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.122 -0.49 . . . . 1.75 110.922 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.21 -36.03 69.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 112.007 0.373 . . . . 0.98999999999999999 112.007 -178.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 18.5 ttt180 -60.39 -51.97 67.24 Favored 'General case' 0 C--N 1.332 -0.158 0 O-C-N 123.35 0.406 . . . . 3.3399999999999999 110.624 179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -60.88 -40.64 93.77 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 1.76 110.965 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -60.88 -43.91 97.79 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.108 0.41 . . . . 1.45 112.108 -178.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.432 ' HB ' HG12 ' A' ' 20' ' ' VAL . 27.4 m -74.85 -36.83 40.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 112.175 0.435 . . . . 1.45 112.175 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.618 ' O ' ' HG2' ' A' ' 42' ' ' MET . 97.2 mt-10 -64.57 -46.73 81.51 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.476 0.655 . . . . 1.8700000000000001 110.771 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.39 -34.47 72.59 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.768 -0.651 . . . . 0.88 111.664 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.64 -32.96 70.46 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.221 0.452 . . . . 0.70999999999999996 112.221 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.618 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 18.8 ptt? -74.89 -29.13 60.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.258 -0.428 . . . . 1.47 110.833 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -76.53 -37.61 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.077 -0.342 . . . . 0.93000000000000005 110.077 178.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -60.73 -53.59 55.55 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.462 -0.79 . . . . 1.72 111.06 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 58.5 mt -77.47 -1.81 32.24 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.691 -0.686 . . . . 0.98999999999999999 111.765 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.3 m120 58.88 50.75 8.12 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.443 0.639 . . . . 2.2000000000000002 110.147 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -80.05 124.58 28.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.39 -0.823 . . . . 1.23 109.837 -178.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.1 pt -119.24 115.16 34.49 Favored Pre-proline 0 C--N 1.317 -0.819 0 C-N-CA 120.73 -0.388 . . . . 1.8799999999999999 110.362 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.554 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 18.6 Cg_endo -58.35 125.53 18.73 Favored 'Trans proline' 0 C--O 1.237 0.473 0 C-N-CA 122.36 2.04 . . . . 0.83999999999999997 111.905 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 54.0 t30 -68.75 115.31 7.95 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.532 -0.758 . . . . 1.1000000000000001 110.615 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 13.9 mtp180 -68.96 -20.98 64.21 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.137 -0.483 . . . . 4.7199999999999998 111.851 -179.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.437 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.6 m -75.91 -31.3 59.11 Favored 'General case' 0 N--CA 1.439 -0.992 0 C-N-CA 119.98 -0.688 . . . . 0.77000000000000002 110.443 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.579 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.65 -28.59 33.53 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.257 0.466 . . . . 0.66000000000000003 112.257 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.568 ' CG ' ' HA ' ' A' ' 51' ' ' ARG . 2.6 pt20 -79.21 -23.46 43.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.253 -0.579 . . . . 1.46 112.126 -177.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -91.6 -20.45 21.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.92 -1.141 . . . . 1.45 107.92 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.753 HD22 HD13 ' B' ' 56' ' ' LEU . 36.3 tp -65.88 -33.1 75.05 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 113.732 -1.577 . . . . 0.78000000000000003 109.903 -178.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.02 7.73 5.71 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.511 -1.222 . . . . 1.0800000000000001 110.6 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -126.99 -116.91 2.05 Favored Glycine 0 N--CA 1.438 -1.192 0 CA-C-N 115.759 -0.655 . . . . 1.6599999999999999 112.271 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -136.34 19.64 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 113.319 0.859 . . . . 4.79 113.319 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.62 ' OE1' ' HA ' ' A' ' 56' ' ' LEU . 0.7 OUTLIER 49.83 37.56 13.71 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.893 0.701 . . . . 2.3399999999999999 112.893 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.4 m -87.99 75.44 8.76 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.379 0.511 . . . . 3.8599999999999999 112.379 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.273 -0.87 . . . . 6.96 109.652 179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.424 ' O ' ' HD3' ' B' ' 3' ' ' PRO . 89.2 mmm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.872 0.368 . . . . 6.9199999999999999 110.239 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -97.77 103.94 19.18 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.101 -0.499 . . . . 6.4199999999999999 109.912 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' B' ' 1' ' ' MET . 73.7 Cg_endo -94.49 90.69 0.12 Allowed 'Trans proline' 0 N--CA 1.448 -1.152 0 C-N-CA 122.188 1.925 . . . . 2.1000000000000001 112.154 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 13.2 m -89.23 147.81 4.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 N-CA-C 108.342 -0.984 . . . . 1.4299999999999999 108.342 178.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.432 ' HA ' ' OP2' ' C' ' 12' ' ' ' DA' . 47.2 p -72.98 153.04 41.1 Favored 'General case' 0 N--CA 1.435 -1.217 0 O-C-N 123.415 0.447 . . . . 0.81000000000000005 111.699 -177.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.501 HD23 ' HA ' ' B' ' 6' ' ' LEU . 5.3 mt -67.46 -23.75 65.54 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 108.695 -0.854 . . . . 0.60999999999999999 108.695 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -65.32 -41.71 93.73 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 107.769 -1.197 . . . . 1.3200000000000001 107.769 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -62.13 -45.31 94.02 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 115.112 -0.949 . . . . 1.9399999999999999 109.71 179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 44.1 t -61.46 -42.35 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 116.008 -0.542 . . . . 1.1399999999999999 110.632 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.04 -43.27 70.04 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 116.114 -0.493 . . . . 0.71999999999999997 111.625 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -34.62 78.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.905 -0.589 . . . . 1.8899999999999999 111.65 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -73.9 -50.38 20.46 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.145 -0.622 . . . . 1.46 111.5 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.89 -26.95 67.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.417 0.895 . . . . 0.67000000000000004 113.417 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.54 43.08 7.51 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.303 -1.427 . . . . 1.21 111.022 -179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 2.4 m -146.73 165.53 7.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 CA-C-N 115.173 -0.514 . . . . 0.71999999999999997 110.331 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -72.63 143.82 48.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 O-C-N 123.635 0.585 . . . . 1.1000000000000001 110.158 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -49.74 -41.89 44.89 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.346 0.659 . . . . 1.49 111.703 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.559 ' HG3' ' N6 ' ' C' ' 15' ' ' ' DA' . 0.0 OUTLIER -57.08 -46.75 82.28 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.082 -0.508 . . . . 1.4299999999999999 110.577 179.15 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -64.87 -33.33 75.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.554 -0.748 . . . . 0.78000000000000003 110.759 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.83 -46.33 93.86 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.473 -0.785 . . . . 1.0800000000000001 111.179 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 25.5 m -65.87 -35.18 79.94 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.41 -0.814 . . . . 1.1200000000000001 110.213 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' B' ' 18' ' ' GLN . 86.0 mtt180 -58.23 -41.98 85.3 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 109.525 -0.546 . . . . 1.8799999999999999 109.525 178.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.517 HG11 ' HB ' ' B' ' 38' ' ' VAL . 92.8 t -69.46 -50.34 51.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 116.082 -0.508 . . . . 1.3899999999999999 111.371 178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -40.92 83.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.294 -0.412 . . . . 1.3100000000000001 110.989 -179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -83.85 -16.17 45.45 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 116.75 -0.205 . . . . 2.1899999999999999 110.615 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 43.11 58.04 3.48 Favored 'General case' 0 CA--C 1.518 -0.275 0 O-C-N 124.001 0.813 . . . . 3.2999999999999998 111.267 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -147.84 48.61 1.07 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.369 -0.832 . . . . 3.0800000000000001 112.764 -179.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 5.6 m -154.13 -152.35 0.41 Allowed 'General case' 0 C--N 1.308 -1.214 0 C-N-CA 119.935 -0.706 . . . . 3.25 110.359 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . 0.442 ' CD2' ' H72' ' D' ' 3' ' ' ' DT' . 3.2 m-70 -84.7 19.86 1.92 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.479 -0.782 . . . . 1.75 109.744 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.466 ' CG1' HG22 ' B' ' 23' ' ' VAL . 3.3 t -47.74 112.42 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 112.813 0.672 . . . . 1.3500000000000001 112.813 -179.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.27 162.2 28.13 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.898 -0.779 . . . . 1.5800000000000001 108.898 177.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . 0.681 ' O ' ' HG2' ' B' ' 35' ' ' ARG . . . -62.85 -54.46 38.49 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 122.244 -0.285 . . . . 1.27 110.969 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.501 ' HA ' ' OE2' ' B' ' 36' ' ' GLU . 13.6 tppt? -58.43 -38.84 78.27 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.143 0.496 . . . . 2.2000000000000002 110.768 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 18.5 m -58.77 -43.39 90.36 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.075 -0.511 . . . . 1.05 111.974 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.681 ' HG2' ' O ' ' B' ' 32' ' ' ALA . 11.5 ptp180 -72.6 -30.22 64.18 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 120.636 -0.426 . . . . 1.54 110.9 -179.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.501 ' OE2' ' HA ' ' B' ' 33' ' ' LYS . 41.0 mt-10 -54.2 -54.89 33.69 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.501 0.667 . . . . 1.97 110.538 179.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -54.05 -49.32 69.24 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.471 -1.24 . . . . 2.5 111.779 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.517 ' HB ' HG11 ' B' ' 23' ' ' VAL . 58.2 t -66.23 -36.17 76.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 112.14 0.422 . . . . 1.3799999999999999 112.14 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 68.7 mt-10 -68.68 -31.91 71.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 O-C-N 122.023 -0.423 . . . . 2.0699999999999998 111.218 -179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.58 91.96 Favored 'General case' 0 N--CA 1.445 -0.71 0 N-CA-C 109.446 -0.575 . . . . 0.91000000000000003 109.446 178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.08 -32.43 72.75 Favored 'General case' 0 C--N 1.344 0.351 0 CA-C-O 120.717 0.294 . . . . 0.72999999999999998 110.476 178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.8 ttm -61.42 -49.28 77.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.452 -0.34 . . . . 1.3999999999999999 110.554 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.83 -45.57 50.45 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.777 0.322 . . . . 1.03 111.408 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -57.35 -47.2 82.24 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.466 -0.788 . . . . 2.1000000000000001 111.918 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.86 -11.81 30.32 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.288 0.477 . . . . 0.83999999999999997 112.288 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 2.5 t30 59.63 67.43 0.89 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.232 0.539 . . . . 1.5600000000000001 111.416 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -77.18 129.81 36.46 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.518 0.675 . . . . 0.88 110.216 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 16.9 mm -117.82 123.61 29.51 Favored Pre-proline 0 C--N 1.319 -0.73 0 N-CA-C 108.203 -1.036 . . . . 1.6000000000000001 108.203 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.39 111.19 1.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.198 1.932 . . . . 1.45 110.258 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.512 HD22 " H4'" ' C' ' 11' ' ' ' DG' . 33.1 t30 -75.99 96.92 3.88 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 108.585 -0.895 . . . . 1.0900000000000001 108.585 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -52.44 -32.09 37.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.43 -0.805 . . . . 3.3900000000000001 111.267 -178.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.42 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 1.6 m -61.26 -44.97 96.38 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 116.859 -0.155 . . . . 0.82999999999999996 111.18 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.67 -44.07 35.32 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 123.561 0.538 . . . . 0.63 110.977 178.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -54.66 -42.92 71.92 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.925 0.393 . . . . 1.3300000000000001 111.759 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -67.97 -40.69 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.234 -0.439 . . . . 3.0299999999999998 110.567 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -68.29 -37.12 80.35 Favored 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 123.613 0.765 . . . . 1.21 111.58 -179.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.05 -3.03 20.62 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 112.403 -179.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.03 63.33 0.26 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.859 -0.686 . . . . 2.0899999999999999 112.715 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 mmtp -84.13 68.05 9.95 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 122.415 -0.462 . . . . 5.9199999999999999 111.004 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -94.05 121.67 35.77 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.193 -0.603 . . . . 4.8300000000000001 109.984 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.38 -30.09 60.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.071 -0.513 . . . . 6.0899999999999999 110.82 -179.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.246 0.914 0 CA-C-O 118.483 -0.77 . . . . 7.79 110.098 -179.681 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.555 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.885 0 C3'-C2'-C1' 99.573 -2.233 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.555 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.5 -1.503 0 C3'-C2'-C1' 99.593 -2.219 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.493 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 O4'-C1'-C2' 103.757 -2.13 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.444 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.248 0 C3'-C2'-C1' 99.389 -2.365 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.444 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.049 0 C3'-C2'-C1' 99.153 -2.534 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.524 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 O4'-C1'-C2' 103.686 -2.194 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.524 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.871 0 C3'-C2'-C1' 99.644 -2.183 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.423 H2'' ' C8 ' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.937 0 C3'-C2'-C1' 99.883 -2.012 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.445 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.786 0 C3'-C2'-C1' 99.558 -2.244 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.445 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-C2' 103.874 -2.024 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.484 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.059 0 C3'-C2'-C1' 100.194 -1.79 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.512 " H4'" HD22 ' B' ' 50' ' ' ASN . . . . . . . . 0 O5'--C5' 1.424 -0.981 0 C3'-C2'-C1' 99.376 -2.374 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.432 ' OP2' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.506 -1.068 0 C3'-C2'-C1' 99.228 -2.48 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.618 0.897 0 C3'-C2'-C1' 100.066 -1.881 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.865 0 C3'-C2'-C1' 99.479 -2.301 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.559 ' N6 ' ' HG3' ' B' ' 18' ' ' GLN . . . . . . . . 0 C2'--C1' 1.507 -0.967 0 C3'-C2'-C1' 99.148 -2.537 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.264 0 C3'-C2'-C1' 99.699 -2.144 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 C3'-C2'-C1' 99.692 -2.148 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.563 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.847 0 C3'-C2'-C1' 99.73 -2.122 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.563 ' C8 ' H2'' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.507 -1.005 0 C3'-C2'-C1' 99.304 -2.425 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.822 0 C3'-C2'-C1' 99.682 -2.155 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.772 0 C3'-C2'-C1' 99.544 -2.254 . . . . 1.8100000000000001 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C3'-C2'-C1' 99.027 -2.623 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.54 0 C1'-O4'-C4' 110.517 0.584 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.958 0 N19-C1'-C2' 115.822 1.014 . . . . 2.52 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.79 H2'' ' H71' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 C3'-C2'-C1' 101.173 -1.09 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.79 ' H71' H2'' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 C3'-C2'-C1' 105.294 1.853 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.547 ' C5 ' " H2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.794 0 N19-C1'-C2' 114.889 0.43 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.512 -0.559 0 O4'-C4'-C3' 104.35 -1.25 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.82 0 C3'-C2'-C1' 100.786 -1.367 . . . . 1.26 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.536 0.753 0 C4'-C3'-C2' 104.623 1.423 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.901 0 C3'-C2'-C1' 105.407 1.933 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 C3'-C2'-C1' 99.439 -2.33 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.422 ' C4 ' ' N4 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.513 -0.568 0 N19-C1'-C2' 116.335 1.335 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.422 ' N4 ' ' C4 ' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 C1'-O4'-C4' 110.497 0.57 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.735 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.531 1.328 0 C1'-O4'-C4' 106.486 -2.296 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.587 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.407 -1.018 0 C1'-O4'-C4' 107.086 -1.867 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.566 ' H71' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.967 0 C3'-C2'-C1' 100.961 -1.242 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.444 ' C5 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.432 -0.497 0 C3'-C2'-C1' 100.622 -1.485 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.503 -1.259 0 O4'-C1'-N19 108.427 0.784 . . . . 1.5900000000000001 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.65 H2'' ' C8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.509 -0.853 0 C3'-C2'-C1' 99.436 -2.331 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.65 ' C8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.94 0 N19-C1'-C2' 113.219 -0.613 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.091 0 C3'-C2'-C1' 100.837 -1.331 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.413 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C5'-C4'-O4' 107.95 -0.906 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.413 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.687 0 C3'-C2'-C1' 100.59 -1.507 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.759 0 O4'-C1'-C2' 105.052 -0.953 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.481 1.122 0 CA-C-O 121.107 0.479 . . . . 5.7999999999999998 110.049 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.0 mttt -101.22 142.26 24.27 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.971 -0.559 . . . . 5.3499999999999996 109.902 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.19 68.55 7.86 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 121.96 1.773 . . . . 2.4300000000000002 112.05 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.558 HG21 ' HB3' ' A' ' 45' ' ' LEU . 2.8 t -104.55 147.21 10.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.163 -0.471 . . . . 1.03 111.515 -179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.497 ' O ' HG23 ' A' ' 9' ' ' VAL . 60.5 p -114.33 179.93 3.81 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 123.59 0.556 . . . . 0.76000000000000001 110.652 179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 pp -70.25 -19.06 63.15 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.069 0.396 . . . . 0.98999999999999999 112.069 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -76.19 -33.98 59.3 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.068 0.461 . . . . 1.51 109.792 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.474 ' HB2' ' CG1' ' A' ' 4' ' ' VAL . 7.0 m-20 -73.27 -48.48 34.33 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.029 -0.532 . . . . 1.6699999999999999 109.918 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 5' ' ' THR . 13.9 t -56.64 -33.12 39.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 115.885 -0.598 . . . . 0.70999999999999996 110.117 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.48 -45.38 93.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.879 0.371 . . . . 0.68000000000000005 111.302 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.95 -44.36 85.26 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.95 -0.568 . . . . 2.3999999999999999 110.87 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -64.37 -39.94 94.85 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.547 -0.751 . . . . 1.47 110.57 -179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.52 -21.91 55.13 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.417 -0.811 . . . . 0.77000000000000002 111.481 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.27 32.32 31.81 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 120.344 -0.932 . . . . 1.3700000000000001 112.373 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.8 m -137.96 -171.31 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 122.351 -0.499 . . . . 0.77000000000000002 110.389 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 84.7 p -77.48 -176.8 4.4 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 109.164 -0.68 . . . . 1.3300000000000001 109.164 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -90.5 2.06 56.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.449 0.642 . . . . 1.3200000000000001 111.255 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.532 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 7.6 tp-100 -94.37 -31.84 13.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.645 -0.707 . . . . 1.4399999999999999 110.687 -179.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -44.2 93.72 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.612 -0.722 . . . . 0.77000000000000002 110.976 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.453 ' HA ' ' CG1' ' A' ' 38' ' ' VAL . 20.3 m -68.35 -43.48 84.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 116.081 -0.509 . . . . 1.3799999999999999 112.261 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.5 t -65.33 -37.25 86.52 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.058 -0.401 . . . . 1.0800000000000001 111.974 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.473 ' CZ ' ' H73' ' C' ' 4' ' ' ' DT' . 5.9 ttp180 -63.14 -34.38 77.49 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.863 0.363 . . . . 2.5499999999999998 111.023 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.2 t -83.14 -31.12 8.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.988 -0.375 . . . . 1.6299999999999999 109.988 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.31 -30.62 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 115.978 -0.555 . . . . 1.3799999999999999 110.275 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -89.43 -4.82 57.84 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.823 -0.626 . . . . 1.6100000000000001 109.385 178.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 63.21 42.13 7.35 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.316 -0.856 . . . . 3.7000000000000002 110.753 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -88.66 128.98 35.61 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.596 -0.274 . . . . 2.1000000000000001 111.157 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.4 m -76.34 68.35 2.7 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.319 0.58 . . . . 1.98 111.224 -179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.1 41.2 0.73 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.48 0.657 . . . . 1.3799999999999999 109.503 179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.7 t -145.59 138.7 21.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 114.484 -1.234 . . . . 1.1100000000000001 109.309 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.1 m -71.86 145.1 48.79 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.997 -0.547 . . . . 1.3200000000000001 109.857 179.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.13 -49.69 40.98 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.844 0.683 . . . . 1.1299999999999999 112.844 -178.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.6 ttpt -55.05 -47.53 74.69 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.071 0.462 . . . . 1.75 111.296 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.06 -37.87 81.78 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.916 -0.584 . . . . 0.98999999999999999 111.149 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.596 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 30.0 ttt180 -59.38 -50.86 72.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.957 -0.565 . . . . 3.3399999999999999 111.033 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -55.64 -43.46 76.22 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.03 0.443 . . . . 1.76 110.729 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -55.15 -42.58 73.25 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.386 -0.825 . . . . 1.45 110.674 -179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 20' ' ' VAL . 77.2 t -70.82 -45.14 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.865 0 CA-C-N 115.349 -0.841 . . . . 1.45 111.307 -179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 35' ' ' ARG . 71.9 mt-10 -56.91 -54.27 48.51 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.69 -0.686 . . . . 1.8700000000000001 110.761 -179.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.5 -40.9 98.19 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.306 -0.861 . . . . 0.88 111.281 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.51 81.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.261 -0.427 . . . . 0.70999999999999996 111.398 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.6 ptp -69.06 -27.89 66.04 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 116.602 -0.272 . . . . 1.47 111.237 -178.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -75.51 -39.91 57.8 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.734 0.302 . . . . 0.93000000000000005 110.652 178.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -60.55 -50.46 73.46 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.149 0.5 . . . . 1.72 110.944 179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HB3' HG21 ' A' ' 4' ' ' VAL . 22.5 mt -83.45 -9.03 59.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.4 -0.364 . . . . 0.98999999999999999 110.536 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 54.57 66.77 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.527 0.68 . . . . 2.2000000000000002 109.286 -177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -89.53 134.17 34.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.83 -1.077 . . . . 1.23 112.235 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.408 ' HA ' ' HD2' ' A' ' 49' ' ' PRO . 6.7 tt -127.57 117.71 21.28 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 115.985 -0.552 . . . . 1.8799999999999999 109.994 178.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.585 ' HA ' ' OP1' ' D' ' 13' ' ' ' DC' . 19.4 Cg_endo -59.06 131.12 39.73 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.975 2.45 . . . . 0.83999999999999997 112.606 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.558 ' O ' ' HG3' ' A' ' 54' ' ' GLN . 15.2 t30 -78.98 119.77 22.61 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 1.1000000000000001 110.575 179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' GLN . 46.8 ttm-85 -76.88 -13.54 59.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.278 -0.419 . . . . 4.7199999999999998 111.894 -178.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.76 -35.16 72.5 Favored 'General case' 0 C--N 1.321 -0.666 0 O-C-N 121.056 -1.028 . . . . 0.77000000000000002 109.617 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.652 ' HB2' HD11 ' B' ' 56' ' ' LEU . . . -81.54 -19.46 42.04 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.593 -0.73 . . . . 0.66000000000000003 109.762 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.558 ' HG3' ' O ' ' A' ' 50' ' ' ASN . 88.5 mt-30 -74.34 -31.25 62.36 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.874 -1.057 . . . . 1.46 110.5 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 62' ' ' LEU . 40.5 mt-30 -90.69 -19.0 24.08 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 108.058 -1.09 . . . . 1.45 108.058 -179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.721 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 41.4 tp -72.87 -36.23 67.33 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 114.234 -1.348 . . . . 0.78000000000000003 110.646 -178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.12 12.83 0.06 Allowed 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.278 0.844 . . . . 1.0800000000000001 113.278 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.446 ' O ' ' HG3' ' A' ' 59' ' ' LYS . . . 122.07 51.57 0.23 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.104 -1.046 . . . . 1.6599999999999999 115.205 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 2.6 mtpt -150.15 -86.46 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.507 0.654 . . . . 4.79 109.903 178.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 55' ' ' GLN . 0.0 OUTLIER 73.69 17.08 3.73 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.505 -0.771 . . . . 2.3399999999999999 110.977 179.078 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.59 -43.61 3.63 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 108.909 -0.774 . . . . 3.8599999999999999 108.909 179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.572 ' O ' ' HG2' ' A' ' 55' ' ' GLN . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.359 -1.305 . . . . 6.96 109.038 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.904 0.383 . . . . 6.9199999999999999 111.046 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.604 ' O ' HG13 ' B' ' 4' ' ' VAL . 40.1 tttm -136.14 115.62 11.05 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 116.247 -0.433 . . . . 6.4199999999999999 109.9 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -57.18 90.99 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.843 2.362 . . . . 2.1000000000000001 111.688 179.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . 0.604 HG13 ' O ' ' B' ' 2' ' ' LYS . 19.7 m -96.62 161.41 2.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.145 -0.48 . . . . 1.4299999999999999 111.442 -178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.6 ' HA ' ' OP1' ' C' ' 12' ' ' ' DA' . 18.9 p -73.0 159.73 33.2 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.748 -0.66 . . . . 0.81000000000000005 110.236 -179.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.448 ' HA ' HD23 ' B' ' 6' ' ' LEU . 6.4 mt -63.55 -23.15 67.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.193 0.52 . . . . 0.60999999999999999 110.067 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -62.64 -47.63 82.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.329 -0.85 . . . . 1.3200000000000001 109.947 179.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -58.0 -46.39 85.3 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.548 -1.205 . . . . 1.9399999999999999 110.397 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.419 HG23 ' H ' ' B' ' 9' ' ' VAL . 1.6 t -62.31 -47.91 90.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.34 -0.846 . . . . 1.1399999999999999 111.158 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.54 -49.5 76.15 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.663 0.602 . . . . 0.71999999999999997 111.677 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -66.28 -38.62 88.2 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.057 0.392 . . . . 1.8899999999999999 112.057 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . 0.424 ' HB3' ' CB ' ' B' ' 41' ' ' ALA . 12.1 t80 -62.31 -39.5 93.23 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 108.939 -0.763 . . . . 1.46 108.939 178.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.93 61.37 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 114.393 -1.276 . . . . 0.67000000000000004 110.782 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.33 -60.39 0.4 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.609 -0.805 . . . . 1.21 111.392 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.7 m -55.19 -177.42 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 116.351 1.982 . . . . 0.71999999999999997 116.351 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 85.9 p -93.0 169.72 10.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 112.57 -2.105 . . . . 1.1000000000000001 111.763 -178.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . 0.432 ' O ' HG12 ' B' ' 20' ' ' VAL . 10.0 t80 -59.89 -37.4 79.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.242 -0.89 . . . . 1.49 110.541 178.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.582 ' HB2' ' H71' ' D' ' 6' ' ' ' DT' . 22.1 tp60 -61.07 -39.4 89.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.824 -0.625 . . . . 1.4299999999999999 111.828 -179.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.1 -35.63 61.75 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.488 -0.485 . . . . 0.78000000000000003 110.623 -178.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 17' ' ' TYR . 0.4 OUTLIER -62.56 -39.3 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 115.92 -0.582 . . . . 1.0800000000000001 110.486 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.481 ' HB2' ' H72' ' C' ' 14' ' ' ' DT' . 14.0 t -62.64 -47.01 85.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 120.881 0.372 . . . . 1.1200000000000001 110.619 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' B' ' 28' ' ' SER . 58.4 mtt180 -53.81 -44.17 69.98 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 1.8799999999999999 111.294 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.69 HG11 HG21 ' B' ' 38' ' ' VAL . 93.5 t -62.38 -46.46 96.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.76 0.314 . . . . 1.3899999999999999 110.183 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -62.77 -40.81 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 N-CA-C 109.374 -0.602 . . . . 1.3100000000000001 109.374 177.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -72.65 -1.24 15.48 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.414 -0.812 . . . . 2.1899999999999999 110.192 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 43.31 42.32 3.56 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.91 0.884 . . . . 3.2999999999999998 112.584 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . 179.54 -171.39 0.15 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.721 0.772 . . . . 3.0800000000000001 112.96 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.508 ' O ' ' HD3' ' B' ' 22' ' ' ARG . 17.4 m 54.65 70.29 0.63 Allowed 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.025 -1.898 . . . . 3.25 116.059 178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . 0.486 ' CD2' ' H71' ' D' ' 3' ' ' ' DT' . 52.5 m80 65.58 64.37 0.58 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 115.364 1.616 . . . . 1.75 115.364 174.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.443 HG13 ' CB ' ' B' ' 22' ' ' ARG . 0.1 OUTLIER -126.61 107.75 17.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.65 -0.705 . . . . 1.3500000000000001 111.315 176.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 8.2 m -52.85 149.22 6.53 Favored 'General case' 0 C--O 1.242 0.703 0 O-C-N 123.271 0.357 . . . . 1.5800000000000001 110.976 178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.92 -8.4 43.95 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.303 0.853 . . . . 1.27 113.303 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -92.19 -41.54 10.38 Favored 'General case' 0 C--N 1.341 0.199 0 N-CA-C 105.765 -1.939 . . . . 2.2000000000000002 105.765 -177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 26.4 m -48.85 -40.16 28.42 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 113.773 -1.558 . . . . 1.05 111.35 176.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 6.4 mtm180 -62.41 -43.6 98.43 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.189 -0.914 . . . . 1.54 110.472 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -74.53 -41.65 60.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.962 0.411 . . . . 1.97 110.803 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -55.69 -42.4 75.15 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.767 -0.651 . . . . 2.5 111.9 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.69 HG21 HG11 ' B' ' 23' ' ' VAL . 32.6 m -78.45 -23.29 13.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 C-N-CA 120.576 -0.45 . . . . 1.3799999999999999 111.231 -179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 22.2 mt-10 -65.02 -29.73 70.66 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.413 -0.588 . . . . 2.0699999999999998 109.413 178.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.94 -52.78 61.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.032 -0.986 . . . . 0.91000000000000003 109.322 178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' HB3' ' B' ' 12' ' ' TYR . . . -65.1 -36.36 84.05 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.512 -0.767 . . . . 0.72999999999999998 110.256 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 4.3 ttm -56.86 -55.56 32.91 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.196 -0.911 . . . . 1.3999999999999999 111.405 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.09 -40.02 65.33 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.36 -0.382 . . . . 1.03 111.944 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -65.02 -46.1 82.72 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.579 0.585 . . . . 2.1000000000000001 112.579 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 64.3 mt -91.25 -16.49 27.52 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 111.94 0.348 . . . . 0.83999999999999997 111.94 -179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' B' ' 2' ' ' LYS . 6.3 t30 62.63 66.21 0.78 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.465 0.65 . . . . 1.5600000000000001 112.02 -178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.41 ' HB2' ' CG2' ' B' ' 9' ' ' VAL . 8.7 t80 -71.92 125.53 27.43 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.68 -0.489 . . . . 0.88 109.68 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 4.9 mm -123.0 121.61 27.19 Favored Pre-proline 0 N--CA 1.442 -0.853 0 N-CA-C 107.854 -1.165 . . . . 1.6000000000000001 107.854 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -60.68 123.34 12.81 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 121.934 1.756 . . . . 1.45 111.82 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.522 ' HB3' " C5'" ' C' ' 12' ' ' ' DA' . 56.8 t-20 -77.17 100.88 5.93 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 114.492 -1.231 . . . . 1.0900000000000001 108.4 -179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' B' ' 55' ' ' GLN . 15.5 tpp180 -56.6 -34.34 67.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 3.3900000000000001 112.061 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . . . . . . . . . 3.3 m -69.94 -48.01 60.09 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 121.199 -0.201 . . . . 0.82999999999999996 111.293 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.37 -52.23 24.03 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 111.477 0.177 . . . . 0.63 111.477 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' B' ' 50' ' ' ASN . 0.0 OUTLIER -54.52 -43.29 71.74 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.685 0.394 . . . . 1.3300000000000001 111.948 -179.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.568 ' HB3' ' O ' ' B' ' 51' ' ' ARG . 0.0 OUTLIER -68.58 -33.92 74.9 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.635 0.731 . . . . 3.0299999999999998 110.003 179.205 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.712 HD13 HD22 ' A' ' 56' ' ' LEU . 0.5 OUTLIER -73.79 -34.33 64.6 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.117 -0.947 . . . . 1.21 110.122 179.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -56.88 -48.19 78.73 Favored 'General case' 0 CA--C 1.509 -0.631 0 O-C-N 123.695 0.622 . . . . 0.98999999999999999 110.132 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 177.17 49.06 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 116.908 -2.567 . . . . 2.0899999999999999 112.445 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.479 ' HG2' ' OE1' ' B' ' 60' ' ' GLN . 12.5 pttm -45.0 -22.55 0.09 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.505 0.928 . . . . 5.9199999999999999 113.505 177.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.479 ' OE1' ' HG2' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -76.01 4.99 7.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.241 0.544 . . . . 4.8300000000000001 111.316 179.922 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 70.7 m -91.97 120.85 33.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.194 0.521 . . . . 6.0899999999999999 109.661 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 C--O 1.247 0.962 0 CA-C-N 114.747 -1.115 . . . . 7.79 111.41 179.973 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.961 0 C3'-C2'-C1' 99.307 -2.423 . . . . 2.4100000000000001 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.412 " H1'" ' C8 ' ' C' ' 2' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.324 0 C3'-C2'-C1' 99.596 -2.217 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.412 ' C8 ' " H1'" ' C' ' 1' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.453 0.673 0 O4'-C1'-C2' 103.752 -2.135 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.645 H2'' ' C7 ' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 O4'--C4' 1.458 1.099 0 C3'-C2'-C1' 99.731 -2.12 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.645 ' C7 ' H2'' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.505 -1.154 0 C3'-C2'-C1' 99.227 -2.481 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.69 H2'' ' H72' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.982 0 C3'-C2'-C1' 99.448 -2.323 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.69 ' H72' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-C2' 103.613 -2.261 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.425 ' H8 ' H2'' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.899 0 C3'-C2'-C1' 99.572 -2.234 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.782 0 C3'-C2'-C1' 99.483 -2.298 . . . . 1.24 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.502 -1.359 0 O4'-C1'-C2' 103.889 -2.01 . . . . 1.01 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.4 ' O2 ' ' HG ' ' A' ' 56' ' ' LEU . . . . . . . . 0 O4'--C4' 1.456 0.885 0 O4'-C1'-C2' 103.729 -2.156 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.584 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 O5'--C5' 1.425 -0.946 0 C3'-C2'-C1' 99.527 -2.266 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.6 ' OP1' ' HA ' ' B' ' 5' ' ' THR . . . . . . . . 0 C2'--C1' 1.505 -1.152 0 C3'-C2'-C1' 99.24 -2.472 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.598 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.818 0 C3'-C2'-C1' 99.651 -2.178 . . . . 0.88 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.598 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.507 -1.012 0 C3'-C2'-C1' 99.405 -2.354 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.506 -1.055 0 C3'-C2'-C1' 99.372 -2.377 . . . . 1.3600000000000001 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.835 0 C3'-C2'-C1' 99.471 -2.306 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . 0.57 H2'' ' C8 ' ' C' ' 18' ' ' ' DA' . . . . . . . . 0 P--O3' 1.597 -0.847 0 C3'-C2'-C1' 99.478 -2.301 . . . . 1.23 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.57 ' C8 ' H2'' ' C' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.749 0 C3'-C2'-C1' 99.082 -2.584 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.453 ' C8 ' " H1'" ' C' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.087 0 C3'-C2'-C1' 99.075 -2.589 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.457 0.997 0 C3'-C2'-C1' 99.726 -2.124 . . . . 1.55 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . 0.472 H2'' ' C8 ' ' C' ' 22' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.51 -0.757 0 C3'-C2'-C1' 99.416 -2.346 . . . . 1.8100000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . 0.472 ' C8 ' H2'' ' C' ' 21' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.505 -1.125 0 C3'-C2'-C1' 99.362 -2.384 . . . . 2.2799999999999998 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 N19-C1'-C2' 116.043 1.152 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.571 " H1'" ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 C3'-C2'-C1' 100.212 -1.777 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.571 ' C8 ' " H1'" ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.685 0 C1'-O4'-C4' 110.644 0.674 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.553 " C2'" ' C6 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.696 0 C3'-C2'-C1' 105.251 1.822 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.553 ' C6 ' " C2'" ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-C2' 105.025 -0.977 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . 0.44 H2'' ' OP2' ' D' ' 6' ' ' ' DT' . . . . . . . . 0 P--O3' 1.62 1.048 0 C3'-C2'-C1' 104.136 1.026 . . . . 1.1299999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.582 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.427 -0.818 0 N19-C1'-C2' 116.297 1.31 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . 0.557 " O4'" " H1'" ' D' ' 6' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.828 0 C3'-C2'-C1' 105.355 1.897 . . . . 1.46 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -1.009 0 C4'-C3'-C2' 104.608 1.408 . . . . 1.6799999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.469 ' C5 ' ' H73' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 P--O3' 1.617 0.854 0 C3'-C2'-C1' 100.567 -1.523 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.541 H2'' ' C5 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.692 0 C3'-C2'-C1' 99.139 -2.544 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.541 ' C5 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 C3'-C2'-C1' 101.701 -0.714 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.721 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C3'--C2' 1.53 1.211 0 C1'-O4'-C4' 105.863 -2.741 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.709 " O5'" H2'' ' D' ' 12' ' ' ' DG' . . . . . . . . 0 C3'--C2' 1.527 0.93 0 C3'-C2'-C1' 105.22 1.8 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.464 H2'' ' C6 ' ' D' ' 15' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.749 0 O4'-C1'-C2' 104.617 -1.348 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . 0.464 ' C6 ' H2'' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 O4'-C4'-C3' 106.523 0.923 . . . . 1.1399999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.564 0 C3'-C2'-C1' 100.531 -1.55 . . . . 1.5900000000000001 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.433 H2'' ' H8 ' ' D' ' 18' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.753 0 O4'-C1'-C2' 104.816 -1.167 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.433 ' H8 ' H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 P--O3' 1.597 -0.833 0 C1'-O4'-C4' 110.298 0.427 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 C4'-C3'-C2' 104.035 0.835 . . . . 1.27 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.524 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.784 0 C4'-C3'-C2' 104.329 1.129 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.537 H2'' ' C6 ' ' D' ' 22' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.741 0 C3'-C2'-C1' 100.549 -1.536 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.406 -1.047 0 C4'-C3'-C2' 104.571 1.371 . . . . 2.4900000000000002 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tmm? . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 109.974 -0.38 . . . . 5.7999999999999998 109.974 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.474 ' O ' HG23 ' A' ' 4' ' ' VAL . 32.8 ttpt -117.02 136.78 23.39 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 109.753 -0.462 . . . . 5.3499999999999996 109.753 179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 28.0 Cg_exo -65.97 75.39 0.33 Allowed 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.017 2.478 . . . . 2.4300000000000002 112.765 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.482 HG12 ' HB2' ' A' ' 8' ' ' ASP . 2.4 t -103.51 155.13 5.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.898 -0.779 . . . . 1.03 108.898 178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 81.1 p -131.25 176.43 8.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.11 -0.7 . . . . 0.76000000000000001 109.11 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 17' ' ' TYR . 0.9 OUTLIER -63.83 -22.12 66.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 111.696 0.258 . . . . 0.98999999999999999 111.696 -179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -75.55 -36.94 60.33 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.003 0.43 . . . . 1.51 110.136 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.482 ' HB2' HG12 ' A' ' 4' ' ' VAL . 30.1 m-20 -67.88 -55.59 12.29 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.57 -0.741 . . . . 1.6699999999999999 109.98 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.461 ' HB ' HG21 ' A' ' 20' ' ' VAL . 17.9 t -54.65 -36.34 35.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.613 -0.722 . . . . 0.70999999999999996 110.774 179.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.79 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.024 -0.535 . . . . 0.68000000000000005 110.913 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -67.72 -39.58 84.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.458 -0.792 . . . . 2.3999999999999999 110.164 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.56 ' HD2' ' HB1' ' A' ' 41' ' ' ALA . 9.9 t80 -65.96 -29.42 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.537 -0.756 . . . . 1.47 110.165 178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.58 ' O ' ' HD3' ' A' ' 37' ' ' LYS . . . -86.07 -26.38 25.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.227 -0.897 . . . . 0.77000000000000002 111.277 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 83.28 34.79 19.49 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.401 -0.904 . . . . 1.3700000000000001 112.083 -179.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.8 -175.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.295 -0.631 . . . . 0.77000000000000002 109.295 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 78.5 p -74.27 -173.09 1.58 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.753 -0.462 . . . . 1.3300000000000001 109.753 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.428 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 40.8 p90 -95.89 2.35 53.58 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.405 0.621 . . . . 1.3200000000000001 110.623 -177.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HB2' ' H71' ' C' ' 6' ' ' ' DT' . 4.7 tp-100 -90.74 -28.7 18.11 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.749 -0.659 . . . . 1.4399999999999999 110.182 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.69 -35.45 80.16 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 115.711 -0.677 . . . . 0.77000000000000002 110.046 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG21 ' HB ' ' A' ' 9' ' ' VAL . 10.7 p -81.47 -23.93 10.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 1.3799999999999999 110.564 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.9 t -83.75 -29.13 27.7 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.206 0.527 . . . . 1.0800000000000001 110.356 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' HG3' ' HB3' ' A' ' 27' ' ' ALA . 1.9 tpp180 -61.37 -24.58 66.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.738 -0.665 . . . . 2.5499999999999998 112.143 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.3 m -90.02 -19.89 7.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.364 -0.534 . . . . 1.6299999999999999 110.936 -178.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.8 t -77.38 -22.78 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.489 0.661 . . . . 1.3799999999999999 109.277 179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -106.71 7.64 30.57 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.954 -1.021 . . . . 1.6100000000000001 110.192 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 46.66 43.0 12.24 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.096 -0.956 . . . . 3.7000000000000002 111.162 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.629 ' HB3' ' HG3' ' A' ' 22' ' ' ARG . . . -84.45 123.07 29.84 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.16 -0.473 . . . . 2.1000000000000001 111.445 -178.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.3 m -78.88 68.93 4.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 1.98 111.777 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -150.13 50.47 0.91 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.763 -0.653 . . . . 1.3799999999999999 109.568 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -150.19 164.63 3.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 CA-C-N 115.077 -0.965 . . . . 1.1100000000000001 109.791 -179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.1 m -88.47 -178.99 5.99 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.876 -0.787 . . . . 1.3200000000000001 108.876 177.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.22 -42.49 23.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.035 0.445 . . . . 1.1299999999999999 110.038 -179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt -60.43 -43.24 96.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.222 -0.899 . . . . 1.75 111.936 -179.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -38.33 58.37 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.826 0.346 . . . . 0.98999999999999999 110.669 -178.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -60.21 -48.11 83.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.733 -0.667 . . . . 3.3399999999999999 111.076 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -71.51 -34.8 70.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.155 -0.475 . . . . 1.76 111.123 -179.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.58 ' HD3' ' O ' ' A' ' 13' ' ' ALA . 24.7 ttmt -62.9 -48.64 78.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.513 -0.312 . . . . 1.45 111.717 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.7 m -65.59 -38.07 81.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 112.243 0.46 . . . . 1.45 112.243 -178.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 42' ' ' MET . 92.3 mt-10 -71.39 -46.51 60.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.709 0.29 . . . . 1.8700000000000001 111.094 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -37.36 84.01 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.936 0.347 . . . . 0.88 111.936 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.56 ' HB1' ' HD2' ' A' ' 12' ' ' TYR . . . -72.19 -30.46 64.98 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.976 0.417 . . . . 0.70999999999999996 111.359 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 39' ' ' GLU . 2.8 ptp -72.18 -36.27 69.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.975 0.417 . . . . 1.47 110.199 -179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.31 -33.01 67.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.01 -0.541 . . . . 0.93000000000000005 110.028 178.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -59.03 -51.17 71.21 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.99 -0.55 . . . . 1.72 110.323 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.29 -7.43 59.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.985 -0.552 . . . . 0.98999999999999999 110.946 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 61.91 56.54 2.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.831 0.824 . . . . 2.2000000000000002 110.136 -179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -83.75 128.65 34.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.69 -1.141 . . . . 1.23 110.638 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.7 tp -113.39 114.19 48.03 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.043 -0.725 . . . . 1.8799999999999999 109.043 178.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_endo -57.77 120.66 8.72 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.426 2.084 . . . . 0.83999999999999997 112.267 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -72.99 107.31 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.809 -0.632 . . . . 1.1000000000000001 111.132 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 54' ' ' GLN . 12.7 tpp180 -72.78 -17.37 61.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.286 -0.416 . . . . 4.7199999999999998 111.725 -178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 m -66.83 -39.64 87.73 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.126 0.488 . . . . 0.77000000000000002 109.702 179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.53 ' HB1' ' N3 ' ' D' ' 12' ' ' ' DG' . . . -78.28 -25.29 46.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.523 -0.762 . . . . 0.66000000000000003 109.619 178.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 51' ' ' ARG . 37.3 mt-30 -64.19 -39.97 95.11 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.04 -0.527 . . . . 1.46 111.6 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.682 ' HA ' ' HB2' ' A' ' 59' ' ' LYS . 18.2 mt-30 -87.63 -19.41 27.79 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.109 -0.7 . . . . 1.45 109.109 -179.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.713 HD23 ' N2 ' ' D' ' 12' ' ' ' DG' . 6.1 tp -64.06 -37.89 89.07 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.635 -1.166 . . . . 0.78000000000000003 110.428 -179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.76 10.11 0.08 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.324 0.861 . . . . 1.0800000000000001 113.324 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.411 ' H ' ' C ' ' A' ' 56' ' ' LEU . . . 97.58 45.47 2.5 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.957 -0.639 . . . . 1.6599999999999999 112.416 178.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.682 ' HB2' ' HA ' ' A' ' 55' ' ' GLN . 28.3 mttp -124.2 6.51 8.48 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.46 0.647 . . . . 4.79 109.331 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.537 HE22 " C5'" ' C' ' 11' ' ' ' DG' . 5.0 mt-30 -79.07 126.91 31.33 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 115.098 -0.956 . . . . 2.3399999999999999 110.448 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.23 98.1 11.57 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.023 -0.535 . . . . 3.8599999999999999 109.886 179.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.259 -0.877 . . . . 6.96 110.743 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.3 ttt . . . . . 0 N--CA 1.484 1.235 0 N-CA-C 110.026 -0.361 . . . . 6.9199999999999999 110.026 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.45 ' H ' ' HD2' ' B' ' 2' ' ' LYS . 0.0 OUTLIER -106.02 132.93 20.47 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 120.888 0.375 . . . . 6.4199999999999999 110.177 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -83.9 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.497 2.131 . . . . 2.1000000000000001 113.099 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -153.81 142.61 13.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 107.411 -1.329 . . . . 1.4299999999999999 107.411 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' THR . . . . . 0.461 ' HA ' ' P ' ' C' ' 12' ' ' ' DA' . 13.7 p -68.42 154.72 41.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.368 -0.533 . . . . 0.81000000000000005 110.394 -177.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.52 HD23 ' HA ' ' B' ' 6' ' ' LEU . 4.9 mt -70.2 -21.4 63.03 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.956 -0.757 . . . . 0.60999999999999999 108.956 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -63.34 -39.68 95.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.072 -0.967 . . . . 1.3200000000000001 109.689 178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -64.09 -44.85 91.09 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.554 0.693 . . . . 1.9399999999999999 110.02 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.44 ' H ' HG23 ' B' ' 9' ' ' VAL . 2.5 t -59.63 -45.93 93.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.804 -1.089 . . . . 1.1399999999999999 111.698 -179.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -51.29 -50.49 59.22 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.113 0.482 . . . . 0.71999999999999997 112.264 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -66.43 -43.95 84.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.683 -0.689 . . . . 1.8899999999999999 112.018 -178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -55.93 -50.91 69.43 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.488 0.661 . . . . 1.46 110.872 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.89 -18.04 64.07 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.825 -1.08 . . . . 0.67000000000000004 112.078 179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 76.2 39.65 31.25 Favored Glycine 0 CA--C 1.506 -0.475 0 C-N-CA 119.545 -1.312 . . . . 1.21 111.013 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.8 -167.78 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.477 -0.564 . . . . 0.71999999999999997 109.477 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . 0.465 ' O ' HG23 ' B' ' 20' ' ' VAL . 87.5 p -109.44 162.02 14.76 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.334 0.587 . . . . 1.1000000000000001 111.058 179.437 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -58.15 -33.83 69.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.072 -0.967 . . . . 1.49 110.252 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.502 ' O ' ' HG2' ' B' ' 22' ' ' ARG . 10.4 tp60 -62.44 -50.86 69.82 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.784 -0.644 . . . . 1.4299999999999999 110.656 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -29.91 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.069 -0.514 . . . . 0.78000000000000003 111.596 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.465 HG23 ' O ' ' B' ' 16' ' ' SER . 42.3 t -56.85 -48.41 81.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.956 -0.566 . . . . 1.0800000000000001 110.075 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -76.05 -30.56 58.44 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.353 -0.385 . . . . 1.1200000000000001 110.809 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.502 ' HG2' ' O ' ' B' ' 18' ' ' GLN . 17.4 mmt180 -52.39 -44.89 65.58 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.887 -0.412 . . . . 1.8799999999999999 109.887 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.443 HG22 HG11 ' B' ' 30' ' ' VAL . 92.1 t -67.3 -51.73 49.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.839 -0.619 . . . . 1.3899999999999999 109.961 178.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.39 -48.79 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 115.296 -0.865 . . . . 1.3100000000000001 111.983 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -85.76 9.38 16.64 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.757 0.313 . . . . 2.1899999999999999 110.993 -179.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 38.02 57.21 1.59 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.092 -0.958 . . . . 3.2999999999999998 111.993 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.27 -0.73 1.9 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 114.965 -1.016 . . . . 3.0800000000000001 113.117 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 17.7 m 70.79 -30.37 0.2 Allowed 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.483 1.29 . . . . 3.25 114.483 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -83.93 45.18 1.06 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.162 0.437 . . . . 1.75 110.993 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.443 HG11 HG22 ' B' ' 23' ' ' VAL . 1.3 t -127.45 126.26 67.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 116.123 -0.489 . . . . 1.3500000000000001 109.849 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 99.7 p -75.38 156.33 35.54 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.022 -0.536 . . . . 1.5800000000000001 110.995 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.54 86.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 1.27 111.201 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -59.71 -41.4 90.72 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.193 0.442 . . . . 2.2000000000000002 112.193 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 17.3 m -71.26 -39.84 71.33 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.924 0.392 . . . . 1.05 109.987 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.413 ' O ' ' HG3' ' B' ' 39' ' ' GLU . 7.5 ttm180 -60.94 -40.74 94.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.068 0.461 . . . . 1.54 109.938 178.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -57.5 -45.86 84.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.846 -1.07 . . . . 1.97 109.704 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -59.1 -59.79 4.9 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.204 -0.907 . . . . 2.5 111.178 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 21.4 t -52.72 -40.79 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 112.073 0.398 . . . . 1.3799999999999999 112.073 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' B' ' 35' ' ' ARG . 27.0 mt-10 -65.11 -33.17 75.38 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.124 -0.489 . . . . 2.0699999999999998 112.017 -178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' B' ' 44' ' ' GLU . . . -62.01 -57.53 11.3 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.729 -0.471 . . . . 0.91000000000000003 109.729 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.93 -39.54 85.86 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.832 -0.622 . . . . 0.72999999999999998 110.928 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 1.6 mtm -53.38 -53.61 48.62 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 112.284 0.476 . . . . 1.3999999999999999 112.284 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.79 -43.34 25.65 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.824 -0.351 . . . . 1.03 111.932 -179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' B' ' 40' ' ' ALA . 0.9 OUTLIER -62.45 -49.69 74.42 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.895 0.702 . . . . 2.1000000000000001 112.895 -178.54 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' B' ' 46' ' ' ASN . 56.6 mt -76.08 -9.34 58.54 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.021 0.378 . . . . 0.83999999999999997 112.021 -178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 45' ' ' LEU . 32.4 t30 69.11 59.18 0.34 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.339 0.59 . . . . 1.5600000000000001 110.76 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 44.0 t80 -78.78 118.45 20.85 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.971 0.891 . . . . 0.88 111.291 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.4 HD11 HD21 ' B' ' 46' ' ' ASN . 9.4 mt -115.04 119.1 39.5 Favored Pre-proline 0 C--N 1.312 -1.062 0 N-CA-C 107.421 -1.326 . . . . 1.6000000000000001 107.421 178.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -58.62 115.63 2.68 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 121.833 1.689 . . . . 1.45 111.346 -178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ASN . . . . . 0.473 ' OD1' ' HB2' ' B' ' 52' ' ' CYS . 46.7 t-20 -75.06 93.12 2.7 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 107.966 -1.124 . . . . 1.0900000000000001 107.966 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -52.84 -33.77 51.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 3.3900000000000001 111.032 -178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' CYS . . . . . 0.473 ' HB2' ' OD1' ' B' ' 50' ' ' ASN . 3.5 m -62.27 -45.22 94.27 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 116.308 -0.406 . . . . 0.82999999999999996 110.028 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.8 -38.72 64.52 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.62 -0.264 . . . . 0.63 110.513 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 50' ' ' ASN . 61.1 mt-30 -59.08 -48.01 83.16 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.987 0.422 . . . . 1.3300000000000001 111.618 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.415 ' HA ' ' HB2' ' B' ' 59' ' ' LYS . 0.1 OUTLIER -66.09 -31.62 72.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.308 0.575 . . . . 3.0299999999999998 110.695 -179.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.657 HD13 HD22 ' A' ' 56' ' ' LEU . 0.3 OUTLIER -75.88 -35.76 59.76 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.898 -1.047 . . . . 1.21 109.753 179.463 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.01 1.29 40.71 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.438 -0.801 . . . . 0.98999999999999999 112.482 -179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 107.1 107.81 3.23 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 119.598 -1.287 . . . . 2.0899999999999999 111.167 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' B' ' 54' ' ' GLN . 7.5 mtpp -131.85 9.0 4.52 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.077 0.465 . . . . 5.9199999999999999 110.049 179.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -118.61 118.79 32.61 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.779 -0.646 . . . . 4.8300000000000001 109.516 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 58.4 m -82.26 2.02 33.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.536 -0.302 . . . . 6.0899999999999999 111.337 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' B' ' 62' ' ' LEU . 3.0 mm? . . . . . 0 C--O 1.245 0.835 0 O-C-N 123.784 0.678 . . . . 7.79 110.44 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' -1' ' ' ' DG' . . . . . 0.596 H2'' ' C8 ' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.51 -0.806 0 C3'-C2'-C1' 99.387 -2.367 . . . . 2.4100000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 1' ' ' ' DA' . . . . . 0.596 ' C8 ' H2'' ' C' ' -1' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.504 -1.204 0 C3'-C2'-C1' 99.176 -2.517 . . . . 2.1200000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 2' ' ' ' DA' . . . . . 0.532 ' C8 ' H2'' ' C' ' 1' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.511 -0.723 0 C3'-C2'-C1' 99.851 -2.035 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 3' ' ' ' DA' . . . . . 0.57 ' C8 ' ' H72' ' C' ' 4' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.069 0 C3'-C2'-C1' 99.095 -2.575 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 4' ' ' ' DT' . . . . . 0.57 ' H72' ' C8 ' ' C' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.499 -1.601 0 C3'-C2'-C1' 98.683 -2.869 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 5' ' ' ' DG' . . . . . 0.506 H2'' ' C7 ' ' C' ' 6' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.864 0 C3'-C2'-C1' 99.634 -2.19 . . . . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 6' ' ' ' DT' . . . . . 0.506 ' C7 ' H2'' ' C' ' 5' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.509 -0.848 0 C3'-C2'-C1' 99.457 -2.316 . . . . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 7' ' ' ' DG' . . . . . 0.412 ' N7 ' ' OH ' ' A' ' 17' ' ' TYR . . . . . . . . 0 C2'--C1' 1.504 -1.189 0 C3'-C2'-C1' 99.212 -2.491 . . . . 1.0700000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 8' ' ' ' DA' . . . . . 0.613 H2'' ' C8 ' ' C' ' 9' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.511 -0.731 0 C3'-C2'-C1' 99.511 -2.278 . . . . 1.24 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 9' ' ' ' DG' . . . . . 0.613 ' C8 ' H2'' ' C' ' 8' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.502 -1.355 0 C3'-C2'-C1' 99.718 -2.13 . . . . 1.01 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 10' ' ' ' DC' . . . . . 0.429 H2'' ' C8 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.1 0 C3'-C2'-C1' 99.736 -2.117 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 11' ' ' ' DG' . . . . . 0.647 ' C2 ' HD21 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.508 -0.957 0 C3'-C2'-C1' 99.752 -2.105 . . . . 0.87 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.508 ' C6 ' ' C5 ' ' C' ' 11' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.506 -1.097 0 C3'-C2'-C1' 98.868 -2.737 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.809 0 C3'-C2'-C1' 99.997 -1.931 . . . . 0.88 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.482 " H1'" ' C8 ' ' C' ' 15' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.083 0 C3'-C2'-C1' 98.794 -2.79 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ' DA' . . . . . 0.482 ' C8 ' " H1'" ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.73 0 O4'-C1'-C2' 103.945 -1.959 . . . . 1.3600000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.508 -0.924 0 C3'-C2'-C1' 99.559 -2.243 . . . . 1.6299999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.507 -0.994 0 C3'-C2'-C1' 99.817 -2.059 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . 0.52 H2'' ' C8 ' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.508 -0.927 0 C3'-C2'-C1' 99.31 -2.422 . . . . 1.1000000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' ' DA' . . . . . 0.524 H2'' ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.777 0 C3'-C2'-C1' 99.626 -2.196 . . . . 1.2 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.524 ' C6 ' H2'' ' C' ' 19' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.506 -1.07 0 C3'-C2'-C1' 99.977 -1.945 . . . . 1.55 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.751 0 C3'-C2'-C1' 99.527 -2.266 . . . . 1.8100000000000001 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.509 -0.827 0 C3'-C2'-C1' 99.368 -2.38 . . . . 2.2799999999999998 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' -1' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.759 0 C4'-C3'-C2' 104.162 0.962 . . . . 2.77 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 1' ' ' ' DG' . . . . . 0.599 H2'' ' C8 ' ' D' ' 2' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 C3'-C2'-C1' 100.945 -1.253 . . . . 2.52 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 2' ' ' ' DG' . . . . . 0.599 ' C8 ' H2'' ' D' ' 1' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.631 0 C4'-C3'-C2' 101.861 -1.339 . . . . 1.97 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 3' ' ' ' DT' . . . . . 0.428 H2'' ' C5 ' ' D' ' 4' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C3'-C2'-C1' 100.971 -1.235 . . . . 1.51 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 4' ' ' ' DT' . . . . . 0.428 ' C5 ' H2'' ' D' ' 3' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.746 0 C4'-C3'-C2' 104.239 1.039 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -0.81 0 C1'-O4'-C4' 110.489 0.563 . . . . 1.1299999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 6' ' ' ' DT' . . . . . 0.501 ' H71' ' HB2' ' B' ' 18' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 C4'-C3'-C2' 102.4 -0.8 . . . . 1.26 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 7' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.408 -0.89 0 C4'-C3'-C2' 104.745 1.545 . . . . 1.46 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 8' ' ' ' DA' . . . . . 0.661 H2'' " O5'" ' D' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 105.233 1.809 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 9' ' ' ' DC' . . . . . 0.661 " O5'" H2'' ' D' ' 8' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.427 -0.824 0 C5'-C4'-C3' 113.586 -0.743 . . . . 1.6799999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 10' ' ' ' DT' . . . . . 0.553 H2'' ' C6 ' ' D' ' 11' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.51 -0.799 0 C3'-C2'-C1' 99.728 -2.123 . . . . 1.4099999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.553 ' C6 ' H2'' ' D' ' 10' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.624 0 C1'-O4'-C4' 110.553 0.609 . . . . 1.96 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 12' ' ' ' DG' . . . . . 0.713 ' N2 ' HD23 ' A' ' 56' ' ' LEU . . . . . . . . 0 C2'--C1' 1.507 -0.989 0 C4'-C3'-C2' 104.423 1.223 . . . . 1.1899999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 13' ' ' ' DC' . . . . . 0.414 " H2'" ' C6 ' ' D' ' 14' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.525 0.741 0 C1'-O4'-C4' 106.626 -2.196 . . . . 0.64000000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 14' ' ' ' DT' . . . . . 0.414 ' C6 ' " H2'" ' D' ' 13' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 104.846 -1.14 . . . . 0.77000000000000002 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.8 0 C5'-C4'-C3' 115.667 0.645 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' D' D ' 16' ' ' ' DA' . . . . . 0.56 H2'' ' C5 ' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-C2' 105.079 -0.928 . . . . 1.5900000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 17' ' ' ' DC' . . . . . 0.575 H2'' " O5'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 105.342 -0.689 . . . . 1.54 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 18' ' ' ' DA' . . . . . 0.575 " O5'" H2'' ' D' ' 17' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-C2' 107.454 1.231 . . . . 1.5600000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 19' ' ' ' DT' . . . . . 0.518 " O4'" " H1'" ' D' ' 18' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.41 -0.736 0 C4'-C3'-C2' 104.614 1.414 . . . . 1.27 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 20' ' ' ' DT' . . . . . 0.484 H2'' ' C6 ' ' D' ' 21' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.783 0 C3'-C2'-C1' 101.768 -0.666 . . . . 1.6899999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 21' ' ' ' DT' . . . . . 0.484 ' C6 ' H2'' ' D' ' 20' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 N19-C1'-C2' 116.231 1.269 . . . . 2.1400000000000001 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' D' D ' 22' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.421 -0.781 0 C4'-C3'-C2' 104.382 1.182 . . . . 2.4900000000000002 . . . . . . . . . . 0 0 . 1 stop_ save_