data_1psy_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 1psy _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 ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.858 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.456 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.762 HD22 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.504 ' O ' HG22 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.84 HG21 HD12 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.449 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.506 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.528 HD11 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.858 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.482 HG22 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.52 HD13 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.52 ' CG2' HD13 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.513 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.691 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.418 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.78 HG23 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.762 ' HB2' HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.413 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG12 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.632 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.78 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.701 HG11 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.486 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HZ1' ' HB3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.669 ' CB ' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.982 HD23 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.405 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 . . . . . 0 C--O 1.216 -0.659 0 CA-C-O 120.76 0.314 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.038 HD22 ' HG ' ' A' ' 113' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.821 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.821 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.669 HG22 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.62 ' O ' HD22 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.591 ' HA ' HG13 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.564 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.701 ' CD2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.444 HG22 ' N ' ' A' ' 86' ' ' ALA . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 1.004 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.753 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.628 ' OE1' HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.753 HD11 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.48 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.699 HD11 HG23 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.699 HG23 HD11 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.75 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.712 HG23 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 1.038 ' HG ' HD22 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.4 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.459 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.982 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 1.004 ' HE3' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.815 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.923 HG12 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.717 ' C ' ' HG ' ' A' ' 28' ' ' SER . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.923 ' HB2' HG12 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.772 HD11 HD13 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.717 ' HG ' ' C ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' SG ' HD12 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.525 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.529 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.529 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.811 ' CD1' ' HG ' ' A' ' 113' ' ' SER . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.837 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.625 HG22 ' CB ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.618 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG13 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.772 HD13 HD11 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.545 ' HA ' HD11 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.636 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.601 ' HA ' HD22 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.502 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.731 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.731 HG23 HD11 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.725 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.599 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.757 HG22 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.811 ' HG ' ' CD1' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.482 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.703 ' NE ' HG13 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.764 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.639 ' HB3' HG22 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.57 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.606 HG21 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HE2' ' NE2' ' A' ' 72' ' ' GLN . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.894 ' HA ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 HG21 ' A' ' 70' ' ' VAL . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HB3' HG23 ' A' ' 110' ' ' ILE . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.463 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.718 HD12 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.754 HG21 HD12 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.41 ' NE2' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.894 HG22 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.491 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.542 ' HA ' HG21 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.747 HG23 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.676 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.676 HD11 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.459 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.409 ' OG ' HD12 ' A' ' 90' ' ' ILE . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.884 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.421 ' HA ' ' HE3' ' A' ' 119' ' ' MET . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.718 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.519 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.573 HD11 HD23 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.683 HG23 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.495 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.469 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.813 HG21 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.718 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.683 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.813 ' HB2' HG21 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.506 HG23 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.739 ' OD2' ' HB3' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.752 ' H ' HD21 ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.884 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.841 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 . . . . . 0 C--O 1.224 -0.275 0 CA-C-O 122.578 1.18 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.468 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.795 ' O ' HG22 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.552 HG11 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.506 ' HB3' HG23 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.414 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.404 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.739 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.517 HG22 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.884 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.58 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.588 ' HA ' HD22 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.449 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.65 ' CD1' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.65 HG23 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.841 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.507 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.46 ' HB2' HD22 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.631 HG12 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.607 ' HD3' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.787 ' HB3' HG23 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p . . . . . 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.52 HG11 ' CE2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.415 ' H ' ' C ' ' A' ' 22' ' ' VAL . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.742 ' HZ1' ' HG2' ' A' ' 74' ' ' ARG . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.83 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.859 HD23 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.733 ' HG ' HE21 ' A' ' 65' ' ' GLN . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' HG23 ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB2' HD12 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.684 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 CA--C 1.538 0.507 0 CA-C-O 121.54 0.686 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.752 HD13 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.733 HE21 ' HG ' ' A' ' 29' ' ' SER . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.686 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.83 HG22 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.742 ' HG2' ' HZ1' ' A' ' 25' ' ' LYS . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.574 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.52 ' CE2' HG11 ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.527 ' N ' HG22 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.6 ' O ' HD22 ' A' ' 95' ' ' LEU . 1.9 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.605 ' CG1' HG13 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.505 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.886 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.886 HG23 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.684 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.503 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.402 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.752 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.697 HG23 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.609 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.46 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.859 ' HG3' HD23 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.697 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.675 ' HB3' HG22 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.419 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.819 HG12 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.819 ' HB2' HG12 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.66 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.44 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' HG22 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.891 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.777 ' HG3' HG13 ' A' ' 73' ' ' VAL . 39.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.535 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.515 ' HZ1' ' HA ' ' A' ' 83' ' ' LYS . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.419 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.483 ' CD1' HG13 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.605 HD11 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.605 ' HA ' HD11 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.572 ' CG2' HD13 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.66 ' CB ' HD12 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.559 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.542 HD11 HD23 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.759 HG23 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.424 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.457 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.891 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.759 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.489 ' H ' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.753 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.518 ' N ' HD21 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.4 ' SG ' HD12 ' A' ' 27' ' ' LEU . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.002 HD22 ' HG ' ' A' ' 113' ' ' SER . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.591 HG13 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.753 HG22 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.562 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.622 ' SG ' HG21 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.581 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.429 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.581 HG21 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.494 ' H ' HG22 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.619 ' O ' HD22 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.421 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.803 HG23 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.564 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.778 HD11 HD13 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.636 HG23 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 1.002 ' HG ' HD22 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.47 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.511 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.591 ' NE ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' HG21 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.636 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.512 ' HD3' HG12 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.622 HG21 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p . . . . . 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.811 ' HA ' HG21 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.942 HD12 HG21 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.428 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.441 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.642 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.514 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.514 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.827 ' CD2' ' HG ' ' A' ' 113' ' ' SER . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.728 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.428 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.942 HG21 HD12 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.88 HG13 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.447 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.88 ' HB3' HG13 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.719 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.473 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.445 ' CD2' ' O ' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.491 HD13 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.551 ' HB3' ' HE2' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.911 ' HA ' HD11 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.603 ' O ' HD22 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.911 HD11 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.529 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.931 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.528 ' HB2' HG22 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.931 HG23 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.703 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.642 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.799 HD11 HD13 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.773 HG12 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.827 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.495 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.773 ' HA ' HG12 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.675 ' HD2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.738 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.634 ' HB3' HG22 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.679 ' HB2' HG21 ' A' ' 116' ' ' VAL . 1.5 tt0 -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' SG ' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.746 HG21 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.443 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.746 ' OD2' HG21 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.885 HD22 ' HB2' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.587 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.526 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.772 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.365 0.126 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.526 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.086 HD13 HD11 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.654 ' SG ' HG21 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 1.03 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.407 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.645 HG22 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.414 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.574 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.753 ' SG ' HG22 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.885 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.602 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.436 ' HA ' ' CE ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.476 HG22 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.619 ' C ' HD11 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.509 ' N ' HD11 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.538 ' O ' HD22 ' A' ' 95' ' ' LEU . 4.2 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.636 ' HA ' HD22 ' A' ' 95' ' ' LEU . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.542 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.786 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.786 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.488 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.772 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.643 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 1.086 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.813 HG23 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.534 ' HB3' HD22 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.499 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 1.03 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.499 ' HB3' HG22 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' THR . . . . . 0.753 HG22 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m . . . . . 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.568 ' O ' HG22 ' A' ' 22' ' ' VAL . 1.9 t . . . . . 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.508 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.681 ' HZ2' ' NH2' ' A' ' 74' ' ' ARG . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.474 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.795 ' CD1' HG21 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.424 ' HA ' HG23 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.642 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.916 HD13 HD11 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.662 ' SG ' HG21 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.795 HG21 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.474 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.681 ' NH2' ' HZ2' ' A' ' 25' ' ' LYS . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.559 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.467 ' CB ' HG13 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.838 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.577 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.508 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.838 HG21 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.402 ' O ' HD22 ' A' ' 95' ' ' LEU . 5.1 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HA ' HD22 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.479 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.892 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.892 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.642 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.916 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.695 HG23 ' CB ' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.795 ' HB2' HD22 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.439 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.684 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.634 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.695 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.454 ' HB3' HG22 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.408 ' HB2' ' CE2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.694 HG21 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.492 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.493 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.694 ' CB ' HG21 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 81' ' ' ALA . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.472 ' SG ' HD11 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.615 ' OE1' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' CD2' HD13 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.757 HD12 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.237 0.065 . . . . 0.0 111.074 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.845 HD12 ' HG ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.847 ' O ' HG22 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.412 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.438 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.462 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.453 ' HB3' ' CG ' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.619 ' HB2' HD21 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.59 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.43 ' O ' HD12 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.444 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.543 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.604 ' HA ' HD22 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.52 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.635 ' N ' HD21 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.623 HG23 HD11 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.757 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.746 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.426 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.74 HG22 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.88 HG23 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.845 ' HG ' HD12 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.501 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.675 ' HA ' HG12 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.617 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.88 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.546 ' CD ' HG11 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.664 HG21 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.664 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.916 HD23 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HB3' HG23 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.671 ' OE2' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.469 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.671 HD13 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 . . . . . 0 C--O 1.202 -1.396 0 CA-C-O 121.139 0.495 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.761 HD13 HD11 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.583 ' O ' HG22 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.439 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.52 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.754 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HD2' HG21 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.511 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.754 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.466 ' HA ' HD11 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.594 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.718 HG13 HG13 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.503 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.811 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.811 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.637 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.779 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.414 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.761 HD11 HD13 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.824 HG23 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.709 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.562 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.747 HG22 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.916 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 117' ' ' ARG . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.824 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.747 ' HB3' HG22 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.587 ' HB2' HG21 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.1 p . . . . . 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.503 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.402 ' NH2' ' HA ' ' A' ' 84' ' ' TYR . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.566 HG11 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.409 ' N ' ' HG ' ' A' ' 28' ' ' SER . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.7 ' CB ' HG22 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.907 HD23 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.409 ' HG ' ' N ' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.447 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.834 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 . . . . . 0 CA--C 1.533 0.319 0 CA-C-O 120.986 0.422 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.531 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.9 mm100 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.78 HD13 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.653 ' O ' HG22 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 2.5 mm100 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.794 HG21 HD12 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.733 HG23 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.733 ' HA ' HG23 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.486 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.556 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.566 ' CD2' HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.834 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.515 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.645 ' HA ' HD22 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.805 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.423 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.422 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.805 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.692 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.615 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.78 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.639 HG23 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.746 ' CB ' HD22 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.522 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.635 ' HA ' HG12 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.486 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.639 ' HB3' HG23 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.477 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.481 HG23 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.637 ' HA ' ' HG ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.542 ' OD1' HG12 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.637 ' HG ' ' HA ' ' A' ' 24' ' ' ARG . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.481 ' SG ' HD11 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.424 ' OE1' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? . . . . . 0 C--O 1.214 -0.802 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.77 ' O ' HG22 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.566 HG21 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.566 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.481 ' HB3' HG23 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.679 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.679 HG21 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.6 ' H ' HG22 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.437 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD22 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.636 HG13 HG13 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.424 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.775 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.486 ' HB2' HG22 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.775 HG23 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.674 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 1.087 HD11 HD13 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.787 ' HG ' ' HB3' ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG12 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.787 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.571 ' CG ' HG12 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.442 ' C ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.834 ' HA ' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.624 ' H ' HD21 ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.549 ' HG ' ' HB3' ' A' ' 65' ' ' GLN . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.513 ' SG ' HD11 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.574 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.74 ' HH ' ' NE2' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.596 HD12 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.74 ' NE2' ' HH ' ' A' ' 33' ' ' TYR . 2.2 mp0 -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.952 HD13 HD11 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HB3' ' HG ' ' A' ' 29' ' ' SER . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.86 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.86 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.834 HG22 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.704 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.652 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.609 ' HG3' HG13 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.678 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.71 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.569 HD13 HG22 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.486 ' OE2' HD12 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.596 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.648 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.405 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.952 HD11 HD13 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.757 HG12 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.552 ' HB2' HD22 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.499 ' O ' HG23 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.451 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.91 HG22 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.573 ' HD3' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.696 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.91 ' HB3' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.675 ' HB2' HG21 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HG2' ' N ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.469 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' N ' HE21 ' A' ' 20' ' ' GLN . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.666 HG23 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.489 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.482 ' HZ1' ' HD3' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.665 ' HA ' HG21 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.838 ' H ' HD21 ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.605 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 121.28 0.562 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.908 HD13 HD11 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.633 ' O ' HG22 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.86 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.482 ' HD3' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.666 ' HB3' HG23 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.402 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 4.1 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.493 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.72 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.613 ' O ' HD22 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.659 HG13 HG13 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.498 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.701 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.438 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.701 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.539 ' HA ' ' HE1' ' A' ' 119' ' ' MET . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.438 ' NE2' ' HA ' ' A' ' 102' ' ' ARG . 17.1 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.722 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.746 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.908 HD11 HD13 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.72 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.403 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.484 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.635 HG12 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.86 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.72 ' HE3' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.635 ' HD3' HG12 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . 0.457 ' NE2' ' CG1' ' A' ' 116' ' ' VAL . 2.9 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.664 ' HB3' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.865 HD12 HG21 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.632 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.414 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.759 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.6 ' NE2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.6 ' H ' ' NE2' ' A' ' 36' ' ' GLN . 1.7 t . . . . . 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 C--O 1.223 -0.321 0 CA-C-O 120.751 0.31 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.414 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.09 HD13 HD11 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.719 ' O ' HG22 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.865 HG21 HD12 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.409 ' N ' HG12 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.509 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.836 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.483 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.836 HG21 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.632 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.689 ' HA ' HD11 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.689 HD11 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.46 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.921 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.432 ' HB2' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.921 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.462 ' O ' ' HE3' ' A' ' 119' ' ' MET . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.759 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.593 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.427 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 1.09 HD11 HD13 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.723 HG23 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.627 ' HG ' HD23 ' A' ' 63' ' ' LEU . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.433 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.508 ' HD2' HG12 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.723 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.591 ' HB3' HG12 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.536 ' SG ' HG22 ' A' ' 22' ' ' VAL . 53.3 t . . . . . 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.442 ' CG ' ' H ' ' A' ' 20' ' ' GLN . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.582 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.582 ' N ' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.536 HG22 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.564 ' OD2' ' HB3' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.917 HD23 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.441 ' SG ' HD11 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.624 ' OE1' HD13 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.624 HD13 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 1.118 HD13 ' HG ' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.798 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.798 HG22 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.667 HG13 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.568 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.544 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.667 ' HG3' HG13 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.564 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.534 ' N ' HD22 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.45 HD11 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.901 ' CB ' ' HE3' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.674 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD22 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.674 HD11 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.463 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.802 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.581 ' OG ' HG23 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.412 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.802 HG23 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.592 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.656 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.419 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.788 ' CD1' HD11 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.675 HG12 ' HA ' ' A' ' 116' ' ' VAL . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 1.118 ' HG ' HD13 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.599 ' O ' HG23 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.77 HG22 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.917 ' HG3' HD23 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.901 ' HE3' ' CB ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.77 ' HB3' HG22 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.546 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.596 HG13 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.469 ' HB2' HG12 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.828 HD23 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.535 ' SG ' HD11 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.636 ' HG2' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.469 ' H ' HD13 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.409 ' HB2' HE22 ' A' ' 89' ' ' GLN . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.975 HD13 HD11 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.885 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.885 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.491 HG13 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.596 ' OE2' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.738 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.76 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.486 HG21 ' O ' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.76 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.572 ' O ' HD22 ' A' ' 95' ' ' LEU . 5.6 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.744 HD11 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . 0.575 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.676 HD22 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' HIS . . . . . 0.575 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.476 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.702 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.975 HD11 HD13 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.857 HG23 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.762 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.567 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.6 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.753 HG12 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.828 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.857 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.753 ' CG ' HG12 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -154.07 166.6 32.52 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.529 0.732 . . . . 0.0 110.128 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -172.76 101.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.151 0.907 . . . . 0.0 110.045 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.48 149.19 23.75 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 121.958 -0.464 . . . . 0.0 109.805 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -170.82 167.57 7.52 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.88 136.81 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.103 0.961 . . . . 0.0 109.653 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -141.81 161.54 37.71 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.442 0.697 . . . . 0.0 110.196 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.94 108.14 0.52 Allowed Glycine 0 C--O 1.222 -0.615 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -144.45 142.33 30.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 177.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.62 167.45 30.1 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 146.89 31.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.483 0.659 . . . . 0.0 110.271 175.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.74 172.35 30.45 Favored Glycine 0 C--O 1.223 -0.588 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 m -116.71 -83.55 0.63 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 119.242 -0.409 . . . . 0.0 111.479 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.847 ' HG ' ' H ' ' A' ' 19' ' ' ARG . 63.5 p -63.73 -157.56 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 176.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 t -59.78 -153.59 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 173.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -39.19 -63.88 0.51 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.272 -0.892 . . . . 0.0 112.78 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -161.65 48.93 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 122.405 1.097 . . . . 0.0 109.861 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m -76.44 -62.72 1.53 Allowed 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.847 ' H ' ' HG ' ' A' ' 14' ' ' SER . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.858 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.456 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -44.91 12.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -171.25 143.4 1.87 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.24 150.93 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.424 1.09 . . . . 0.0 111.638 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.39 175.38 13.94 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.756 -0.59 . . . . 0.0 109.729 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -53.92 159.16 1.81 Allowed 'General case' 0 C--N 1.333 -0.149 0 O-C-N 123.645 0.591 . . . . 0.0 111.014 176.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.27 -156.21 0.32 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.1 p -82.1 129.44 34.81 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.961 1.304 . . . . 0.0 111.407 176.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 138.24 118.91 1.7 Allowed Glycine 0 C--O 1.226 -0.388 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.46 1.84 13.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 174.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -96.11 61.52 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 120.7 -1.25 . . . . 0.0 111.326 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.485 ' O ' HG11 ' A' ' 47' ' ' VAL . 69.6 t -150.89 59.31 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 123.571 1.653 . . . . 0.0 108.394 -177.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.509 HD22 ' N ' ' A' ' 48' ' ' LEU . 1.7 pt? -132.11 38.57 3.49 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 120.511 -1.368 . . . . 0.0 109.418 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.58 132.91 26.6 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.9 mtm -73.01 -53.88 4.78 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 124.59 1.182 . . . . 0.0 112.961 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -72.92 -18.45 24.41 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.406 2.071 . . . . 0.0 111.609 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.47 108.34 0.16 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.14 -63.83 1.16 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.443 0.64 . . . . 0.0 110.561 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.74 74.28 5.79 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.766 0.793 . . . . 0.0 109.733 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -179.31 156.89 0.77 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.931 0.892 . . . . 0.0 108.898 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.35 119.87 1.13 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.339 0.655 . . . . 0.0 111.683 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.24 92.28 0.08 Allowed 'General case' 0 CA--C 1.515 -0.401 0 O-C-N 124.134 0.896 . . . . 0.0 109.363 -174.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 177.11 138.88 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -48.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 123.107 1.432 . . . . 0.0 111.902 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.8 p -168.48 56.92 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.971 1.367 . . . . 0.0 108.96 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -61.08 -14.14 21.9 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.456 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.762 HD22 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.504 ' O ' HG22 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.84 HG21 HD12 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.449 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.506 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.546 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.528 HD11 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.858 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.482 HG22 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.52 HD13 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.52 ' CG2' HD13 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.513 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.691 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.418 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.78 HG23 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.762 ' HB2' HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.413 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG12 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.632 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.78 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.485 ' O ' HG22 ' A' ' 124' ' ' THR . 19.5 p -142.65 -177.91 5.53 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.19 136.37 30.31 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.781 0.719 . . . . 0.0 111.882 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.485 HG22 ' O ' ' A' ' 122' ' ' THR . 26.0 p -136.18 -47.14 0.64 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-O 115.37 -2.253 . . . . 0.0 108.231 -174.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 112.195 -3.764 . . . . 0.0 110.488 -173.32 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -166.3 152.0 8.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -177.25 162.06 1.9 Allowed 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 124.25 0.969 . . . . 0.0 110.298 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.5 ttt 171.51 131.26 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 O-C-N 124.917 1.386 . . . . 0.0 110.462 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.14 166.95 28.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 118.528 -0.748 . . . . 0.0 109.314 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.5 p 167.6 160.02 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 125.695 1.872 . . . . 0.0 108.768 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.65 158.35 0.13 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.703 1.201 . . . . 0.0 110.3 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.45 102.86 1.38 Allowed Glycine 0 C--O 1.228 -0.244 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -165.98 149.32 7.6 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.507 -0.407 . . . . 0.0 110.363 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.98 169.33 23.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 116.607 -1.663 . . . . 0.0 109.902 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.36 -162.53 1.57 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.257 0.973 . . . . 0.0 111.308 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.11 72.01 0.81 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.44 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.504 0.668 . . . . 0.0 110.557 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 p -59.49 151.7 23.51 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.407 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -174.85 0.06 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.689 178.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -57.11 -42.05 80.1 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.385 -0.822 . . . . 0.0 110.77 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -175.86 40.37 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.67 -25.91 49.9 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 179.029 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.701 HG11 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.486 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.498 ' HZ1' ' HB3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.669 ' CB ' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.982 HD23 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.405 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.75 -150.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -113.76 51.51 0.86 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.83 0.852 . . . . 0.0 111.03 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.5 p -154.16 151.24 29.0 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.528 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 ttm105 -89.6 81.04 6.54 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.71 -0.619 . . . . 0.0 110.507 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -57.95 132.72 54.26 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 116.384 -1.769 . . . . 0.0 109.325 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.8 m -169.67 136.23 1.59 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 126.069 2.106 . . . . 0.0 108.606 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.8 m -91.96 5.92 48.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.651 0.738 . . . . 0.0 111.468 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.22 -120.26 0.98 Allowed Glycine 0 N--CA 1.447 -0.573 0 O-C-N 121.234 -0.916 . . . . 0.0 111.345 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -163.37 -49.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 109.78 7.66 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 122.421 1.105 . . . . 0.0 108.983 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 47' ' ' VAL . 1.3 p -87.64 24.16 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 122.379 1.085 . . . . 0.0 111.091 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.8 mt -105.22 59.18 0.68 Allowed 'General case' 0 C--N 1.326 -0.425 0 O-C-N 120.324 -1.485 . . . . 0.0 108.31 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.36 23.95 13.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 O-C-N 121.422 -0.799 . . . . 0.0 111.81 176.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -143.0 161.35 49.01 Favored Pre-proline 0 N--CA 1.443 -0.783 0 C-N-CA 122.319 0.248 . . . . 0.0 111.548 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.98 68.79 6.45 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.742 2.294 . . . . 0.0 110.202 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -101.82 21.19 43.07 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 114.507 -3.385 . . . . 0.0 110.249 177.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.89 -43.73 66.38 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.3 2.05 . . . . 0.0 110.207 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.53 65.97 7.91 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 122.563 1.173 . . . . 0.0 110.158 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -119.37 152.33 36.98 Favored 'General case' 0 N--CA 1.441 -0.889 0 O-C-N 120.967 -1.083 . . . . 0.0 109.256 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -48.76 131.57 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.88 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -134.83 117.28 15.74 Favored 'General case' 0 CA--C 1.504 -0.81 0 O-C-N 124.214 0.946 . . . . 0.0 109.549 -177.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 175.94 -73.51 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 O-C-N 124.366 1.041 . . . . 0.0 110.121 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -147.75 37.39 0.89 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 123.266 1.508 . . . . 0.0 109.185 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.88 ' CB ' HD21 ' A' ' 63' ' ' LEU . 4.0 p -173.05 67.49 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 123.276 1.513 . . . . 0.0 108.789 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -70.5 -27.53 64.27 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 119.99 -1.694 . . . . 0.0 110.342 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.038 HD22 ' HG ' ' A' ' 113' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.821 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.821 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.669 HG22 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.409 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.62 ' O ' HD22 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.591 ' HA ' HG13 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.564 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.701 ' CD2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.444 HG22 ' N ' ' A' ' 86' ' ' ALA . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 1.004 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.753 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.628 ' OE1' HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.753 HD11 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.48 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.699 HD11 HG23 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.699 HG23 HD11 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.551 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.75 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.712 HG23 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 1.038 ' HG ' HD22 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.4 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.459 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.982 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 1.004 ' HE3' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.676 HG21 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -97.13 -165.56 1.28 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.676 ' H ' HG21 ' A' ' 122' ' ' THR . 3.0 mtm180 -83.95 89.08 7.17 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 115.46 -2.21 . . . . 0.0 108.209 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 42.0 p -39.54 -81.74 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 O-C-N 126.755 2.534 . . . . 0.0 115.049 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.409 ' OXT' ' HB3' ' A' ' 75' ' ' ASP . 1.7 m-20 . . . . . 0 C--O 1.241 0.651 0 O-C-N 126.228 2.205 . . . . 0.0 107.915 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -143.87 -82.51 0.17 Allowed 'General case' 0 C--O 1.234 0.282 0 O-C-N 123.682 0.614 . . . . 0.0 109.66 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -172.93 178.67 2.49 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -101.29 -172.51 2.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 123.821 0.701 . . . . 0.0 111.992 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.78 160.83 15.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.991 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.0 p 171.72 156.76 0.08 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.407 0.622 . . . . 0.0 109.792 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -169.11 165.96 11.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.1 103.51 0.93 Allowed Glycine 0 C--O 1.218 -0.888 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.72 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -166.16 -56.08 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.534 0.683 . . . . 0.0 110.369 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -159.87 161.42 34.41 Favored 'General case' 0 CA--C 1.514 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 110.96 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -87.37 -159.99 0.56 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 123.779 0.675 . . . . 0.0 110.676 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.74 -165.25 25.91 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.6 t -89.02 29.89 1.0 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.479 . . . . 0.0 110.91 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.532 ' HG ' ' HB2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -165.0 -172.18 2.48 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 121.868 -0.52 . . . . 0.0 110.006 -179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -54.78 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 124.315 1.009 . . . . 0.0 110.869 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 15' ' ' SER . 2.6 tt0 -40.8 -57.59 1.89 Allowed 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.341 -0.849 . . . . 0.0 110.558 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -177.24 49.29 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.936 1.351 . . . . 0.0 109.936 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.815 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -78.18 -38.65 42.93 Favored 'General case' 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.532 ' HB2' ' HG ' ' A' ' 14' ' ' SER . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.923 HG12 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.717 ' C ' ' HG ' ' A' ' 28' ' ' SER . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.923 ' HB2' HG12 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.772 HD11 HD13 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.717 ' HG ' ' C ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' SG ' HD12 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.525 ' CD ' HD23 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.529 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -84.02 -150.72 0.11 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -127.59 40.17 3.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.863 0.839 . . . . 0.0 110.351 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -166.02 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 122.132 0.968 . . . . 0.0 110.186 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -167.93 97.9 0.45 Allowed 'General case' 0 CA--C 1.506 -0.745 0 O-C-N 121.818 -0.551 . . . . 0.0 110.257 178.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.92 157.46 0.88 Allowed 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.469 0.48 . . . . 0.0 110.153 178.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.9 t -172.51 144.0 1.43 Allowed 'General case' 0 C--N 1.322 -0.589 0 O-C-N 123.922 0.764 . . . . 0.0 109.822 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -70.53 97.43 1.31 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.575 1.178 . . . . 0.0 109.819 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.32 -118.23 0.44 Allowed Glycine 0 C--O 1.225 -0.429 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -165.69 -54.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.977 0.457 . . . . 0.0 110.768 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.17 119.29 10.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.281 1.039 . . . . 0.0 109.236 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.34 53.2 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.554 HD11 ' O ' ' A' ' 48' ' ' LEU . 0.2 OUTLIER -172.93 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 124.17 1.938 . . . . 0.0 108.736 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.08 28.71 0.89 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 118.172 -2.83 . . . . 0.0 110.513 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -137.82 62.31 33.63 Favored Pre-proline 0 N--CA 1.446 -0.657 0 CA-C-O 121.397 0.618 . . . . 0.0 111.667 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -72.61 70.89 3.31 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.269 1.979 . . . . 0.0 112.141 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.8 -4.31 10.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-O 118.259 -1.301 . . . . 0.0 111.277 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 170.96 108.99 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 117.343 -1.313 . . . . 0.0 110.416 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -33.76 108.82 0.06 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.644 1.688 . . . . 0.0 112.122 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -110.81 33.6 4.48 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 120.312 -1.492 . . . . 0.0 109.039 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -106.37 164.38 12.08 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.141 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -123.07 -41.52 2.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.333 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.76 -54.6 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.349 0.406 . . . . 0.0 110.448 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.25 86.7 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 123.841 1.782 . . . . 0.0 110.321 -178.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.5 p -171.25 83.7 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 O-C-N 119.137 -2.227 . . . . 0.0 108.78 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -33.78 15.33 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.529 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.811 ' CD1' ' HG ' ' A' ' 113' ' ' SER . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.837 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.837 HG22 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.625 HG22 ' CB ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.618 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG13 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.772 HD13 HD11 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.851 ' HZ2' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.484 HG22 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.545 ' HA ' HD11 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.636 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.601 ' HA ' HD22 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.502 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.731 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.731 HG23 HD11 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.725 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.599 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.757 HG22 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.764 HG13 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.811 ' HG ' ' CD1' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.482 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.703 ' NE ' HG13 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.851 ' HB3' ' HZ2' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.764 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.639 ' HB3' HG22 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p -92.08 -169.24 2.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.629 ' C ' HG21 ' A' ' 124' ' ' THR . 0.0 OUTLIER -56.76 83.52 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.47 0 O-C-N 121.271 -0.893 . . . . 0.0 112.386 -179.332 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.629 HG21 ' C ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER 158.74 152.49 0.01 OUTLIER 'General case' 0 C--O 1.238 0.481 0 O-C-N 124.328 1.017 . . . . 0.0 112.176 -170.301 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.5 p30 . . . . . 0 CA--C 1.558 1.27 0 CA-C-O 116.266 -1.826 . . . . 0.0 111.821 175.026 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -157.4 167.66 29.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.878 -0.582 . . . . 0.0 109.572 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -159.78 112.09 2.09 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.361 1.038 . . . . 0.0 109.407 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -140.65 167.37 22.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.294 0.569 . . . . 0.0 110.376 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 167.24 15.71 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 171.32 133.66 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.858 0.863 . . . . 0.0 109.54 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -163.53 174.88 11.27 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.619 0.768 . . . . 0.0 109.942 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 173.33 96.59 0.1 Allowed Glycine 0 C--O 1.221 -0.664 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.8 144.68 32.68 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 177.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.52 166.66 31.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.393 0.677 . . . . 0.0 110.231 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -141.67 156.88 45.62 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.616 0.572 . . . . 0.0 109.835 175.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.91 150.34 3.83 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-O 122.64 1.133 . . . . 0.0 112.562 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.91 78.95 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -177.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -59.42 171.25 0.84 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.651 174.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -176.01 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.334 175.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -40.77 -62.69 0.76 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.175 0.988 . . . . 0.0 112.893 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -161.37 37.39 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 123.222 1.487 . . . . 0.0 109.672 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.57 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.93 -42.8 69.37 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 177.188 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.606 HG21 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.41 ' HE2' ' NE2' ' A' ' 72' ' ' GLN . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.894 ' HA ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.754 HD12 HG21 ' A' ' 70' ' ' VAL . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.518 ' HB3' HG23 ' A' ' 110' ' ' ILE . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.463 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.718 HD12 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.54 -47.52 9.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -162.77 100.81 1.01 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 m -37.89 155.78 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 123.332 1.539 . . . . 0.0 114.525 169.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -168.89 78.31 0.12 Allowed 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 118.965 -2.335 . . . . 0.0 108.2 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.608 ' HD3' HG23 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -43.85 132.12 5.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 t -78.01 -152.91 0.06 Allowed 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.021 1.451 . . . . 0.0 108.144 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 p -138.45 94.23 2.83 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 125.51 1.524 . . . . 0.0 109.171 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -146.01 12.2 1.66 Allowed Glycine 0 C--O 1.216 -0.999 0 CA-C-O 118.078 -1.401 . . . . 0.0 112.719 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -142.75 -85.09 0.16 Allowed 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 118.318 1.059 . . . . 0.0 110.298 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -141.04 27.23 1.98 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 123.85 1.786 . . . . 0.0 110.414 -177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.608 HG23 ' HD3' ' A' ' 41' ' ' ARG . 36.6 t -88.77 17.13 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.491 -1.381 . . . . 0.0 109.801 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.61 HD11 ' O ' ' A' ' 48' ' ' LEU . 1.8 pp -100.5 34.09 2.51 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 120.535 -1.353 . . . . 0.0 109.735 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -39.71 151.45 0.04 OUTLIER 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 123.349 0.659 . . . . 0.0 109.529 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -38.39 -53.97 2.93 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 175.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -70.33 -36.87 8.59 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 122.46 2.107 . . . . 0.0 113.033 174.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.27 -56.2 3.24 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 126.416 1.96 . . . . 0.0 110.569 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.56 -68.37 0.18 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.588 1.955 . . . . 0.0 109.89 177.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.49 167.74 10.18 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 123.123 1.439 . . . . 0.0 112.052 175.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.414 ' HB3' ' NE2' ' A' ' 64' ' ' GLN . 2.2 t30 -131.88 -157.98 0.86 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.222 176.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.66 114.06 0.24 Allowed 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 111.35 174.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -46.52 140.41 4.34 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 124.323 1.015 . . . . 0.0 110.944 -174.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 177.79 131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -176.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -72.67 55.44 0.37 Allowed 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 122.536 1.16 . . . . 0.0 112.127 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 172.55 79.89 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.59 1.156 . . . . 0.0 109.278 -177.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -56.62 -31.38 64.26 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.573 HD23 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 55' ' ' ASN . 28.3 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.754 HG21 HD12 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.41 ' NE2' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.894 HG22 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.491 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.542 ' HA ' HG21 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.747 HG23 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.676 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.676 HD11 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.409 ' OG ' HD12 ' A' ' 90' ' ' ILE . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.884 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.421 ' HA ' ' HE3' ' A' ' 119' ' ' MET . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.718 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.519 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.573 HD11 HD23 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.683 HG23 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.495 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.469 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.813 HG21 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.718 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.683 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.644 ' HB3' HG22 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.813 ' HB2' HG21 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p -142.26 178.51 7.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -45.43 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.775 1.23 . . . . 0.0 112.349 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -89.49 106.86 18.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 124.912 1.382 . . . . 0.0 108.465 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.253 1.281 0 O-C-N 124.448 1.092 . . . . 0.0 111.428 -179.341 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.01 110.91 0.72 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.973 0.892 . . . . 0.0 110.873 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.483 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 53.1 p90 -71.81 157.09 38.51 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.72 -1.238 . . . . 0.0 111.439 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.65 106.21 0.23 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.178 0.513 . . . . 0.0 111.098 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.483 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 7.5 pt-20 -152.49 168.78 24.41 Favored 'General case' 0 CA--C 1.492 -1.275 0 CA-C-O 116.8 -1.571 . . . . 0.0 109.206 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 172.51 37.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 125.324 1.64 . . . . 0.0 109.303 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.25 165.11 24.29 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 119.929 -1.732 . . . . 0.0 111.445 177.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -159.42 -106.97 0.23 Allowed Glycine 0 C--O 1.225 -0.445 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -157.33 158.84 36.76 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -158.32 161.8 37.67 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.536 0.334 . . . . 0.0 110.266 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -82.7 -163.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.419 1.074 . . . . 0.0 111.424 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -41.67 163.32 0.02 OUTLIER Glycine 0 CA--C 1.538 1.503 0 CA-C-O 124.401 2.112 . . . . 0.0 113.161 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.8 m -119.89 -133.85 0.31 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 120.693 -1.475 . . . . 0.0 109.0 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.608 ' HG ' ' HD2' ' A' ' 19' ' ' ARG . 16.4 p -168.4 -170.39 1.25 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 124.401 1.08 . . . . 0.0 111.538 178.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.429 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.9 OUTLIER -70.07 154.0 42.48 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 -176.467 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -60.68 -16.77 42.72 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.188 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -175.05 83.22 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 122.567 1.175 . . . . 0.0 110.34 178.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.429 ' HB2' ' CB ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -158.92 -47.13 0.06 Allowed 'General case' 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 178.757 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.608 ' HD2' ' HG ' ' A' ' 14' ' ' SER . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.506 HG23 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.739 ' OD2' ' HB3' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.752 ' H ' HD21 ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.884 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.841 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.15 -63.59 1.28 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.7 t -154.86 83.87 1.09 Allowed 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -39.86 157.17 0.02 OUTLIER 'General case' 0 C--N 1.35 0.616 0 CA-C-O 123.68 1.705 . . . . 0.0 110.89 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.77 125.48 1.19 Allowed 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 118.663 -2.523 . . . . 0.0 108.082 176.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -43.88 133.48 4.87 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 125.324 1.64 . . . . 0.0 110.011 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.5 p -70.32 -153.57 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.279 1.514 . . . . 0.0 110.41 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -63.75 141.46 58.76 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.023 -1.048 . . . . 0.0 112.362 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 136.01 121.42 2.08 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.51 0.63 11.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.441 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.87 55.16 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 124.686 2.184 . . . . 0.0 112.554 177.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.679 ' O ' HD22 ' A' ' 48' ' ' LEU . 41.1 t -147.69 52.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 116.907 -3.62 . . . . 0.0 108.504 -173.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.679 HD22 ' O ' ' A' ' 47' ' ' VAL . 1.0 OUTLIER -143.95 51.08 1.32 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -175.919 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.79 130.56 0.76 Allowed 'General case' 0 C--N 1.349 0.554 0 C-N-CA 123.144 0.577 . . . . 0.0 109.603 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -53.6 40.9 Favored Pre-proline 0 C--N 1.327 -0.411 0 O-C-N 124.513 1.133 . . . . 0.0 112.241 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -74.36 -43.34 0.52 Allowed 'Trans proline' 0 N--CA 1.441 -1.59 0 CA-C-O 113.937 -2.609 . . . . 0.0 111.332 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 37.25 82.52 0.01 OUTLIER Glycine 0 C--N 1.343 0.936 0 O-C-N 127.229 2.83 . . . . 0.0 111.875 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.39 -60.37 0.03 OUTLIER 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.158 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -73.02 55.38 0.41 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.694 1.197 . . . . 0.0 110.833 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.415 ' HB3' ' CG ' ' A' ' 64' ' ' GLN . 5.3 m120 -161.39 116.58 2.07 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 125.773 1.629 . . . . 0.0 108.37 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -42.1 104.33 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 124.774 1.296 . . . . 0.0 111.283 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.09 91.87 2.87 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 124.158 0.911 . . . . 0.0 108.654 -174.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 178.86 -72.97 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.944 0.778 . . . . 0.0 110.538 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -122.25 20.42 10.55 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 122.446 1.117 . . . . 0.0 109.97 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.61 43.47 0.09 Allowed 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 120.291 -1.506 . . . . 0.0 107.286 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -54.22 -19.5 5.31 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.4 -1.437 . . . . 0.0 111.683 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.468 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.066 HD13 HD11 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.415 ' CG ' ' HB3' ' A' ' 55' ' ' ASN . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.795 ' O ' HG22 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.403 HD22 ' ND2' ' A' ' 55' ' ' ASN . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.795 HG22 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.552 HG11 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.506 ' HB3' HG23 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.432 ' CD ' ' O ' ' A' ' 123' ' ' ARG . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.404 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.739 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.504 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.517 HG22 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.884 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.58 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.588 ' HA ' HD22 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.449 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.65 ' CD1' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.65 HG23 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.841 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.507 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 1.066 HD11 HD13 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.787 HG23 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.46 ' HB2' HD22 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.631 HG12 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.607 ' HD3' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.787 ' HB3' HG23 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.631 ' HG2' HG12 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p -90.08 -167.08 1.74 Allowed 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.432 ' O ' ' CD ' ' A' ' 78' ' ' GLN . 6.1 mtm180 -39.47 -90.18 0.0 OUTLIER 'General case' 0 C--O 1.196 -1.731 0 CA-C-O 116.64 -1.648 . . . . 0.0 111.199 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -65.15 82.91 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 125.17 1.388 . . . . 0.0 111.118 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 . . . . . 0 CA--C 1.562 1.411 0 CA-C-O 115.515 -2.184 . . . . 0.0 112.595 -171.554 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.759 0 CA-C-O 117.425 -1.274 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.68 -57.2 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 125.129 1.518 . . . . 0.0 109.812 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -176.5 156.9 1.57 Allowed 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 123.457 0.473 . . . . 0.0 110.164 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.6 ptm -175.92 128.92 0.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.132 0.895 . . . . 0.0 110.335 177.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.61 164.64 1.05 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.75 109.03 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.534 0.521 . . . . 0.0 109.682 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -167.69 132.58 1.88 Allowed 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.76 -110.37 0.66 Allowed Glycine 0 C--O 1.222 -0.6 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.59 144.18 3.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.912 0.387 . . . . 0.0 110.369 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 172.42 6.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.359 0.599 . . . . 0.0 111.26 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.62 29.82 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 122.047 0.927 . . . . 0.0 111.185 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.97 137.2 4.4 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.4 p -176.01 69.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.203 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.657 ' HG ' ' HD2' ' A' ' 19' ' ' ARG . 8.5 p -165.29 179.29 6.33 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 118.601 -0.714 . . . . 0.0 110.291 179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 O-C-N 124.879 1.362 . . . . 0.0 110.753 177.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -41.9 -55.41 3.1 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.316 -0.24 . . . . 0.0 111.169 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -175.17 40.67 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.924 1.345 . . . . 0.0 110.322 176.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.454 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -67.9 -34.15 76.1 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 178.645 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.657 ' HD2' ' HG ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.464 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.52 HG11 ' CE2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.415 ' H ' ' C ' ' A' ' 22' ' ' VAL . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.742 ' HZ1' ' HG2' ' A' ' 74' ' ' ARG . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.83 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.859 HD23 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.733 ' HG ' HE21 ' A' ' 65' ' ' GLN . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' HG23 ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.537 ' HB2' HD12 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.508 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.684 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.74 -61.35 1.81 Allowed 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p 160.01 48.5 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.568 1.147 . . . . 0.0 111.071 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -85.79 146.16 26.9 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 120.727 -1.233 . . . . 0.0 110.523 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -170.34 125.4 0.75 Allowed 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -177.64 131.75 0.16 Allowed 'General case' 0 C--O 1.207 -1.179 0 O-C-N 123.794 0.684 . . . . 0.0 110.247 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 48.7 p -161.94 102.67 1.15 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 119.158 0.89 . . . . 0.0 108.936 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.8 m -144.43 10.75 1.46 Allowed 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.147 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.483 ' N ' HD23 ' A' ' 48' ' ' LEU . . . -133.84 -119.55 2.0 Allowed Glycine 0 C--N 1.338 0.67 0 CA-C-O 122.153 0.863 . . . . 0.0 114.742 172.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -86.72 23.72 1.62 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.444 1.116 . . . . 0.0 111.245 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.679 ' OE1' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -79.26 -153.87 0.08 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 120.583 -1.323 . . . . 0.0 110.681 -179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.679 HG11 ' OE1' ' A' ' 46' ' ' GLU . 2.5 p -74.64 49.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 123.981 1.848 . . . . 0.0 110.933 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.657 HD11 ' O ' ' A' ' 48' ' ' LEU . 0.7 OUTLIER -129.44 30.13 4.99 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 119.041 -2.287 . . . . 0.0 109.408 178.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.5 27.09 7.14 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.187 -1.571 . . . . 0.0 112.349 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.428 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.0 OUTLIER 168.19 -54.9 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 C-N-CA 124.079 0.952 . . . . 0.0 111.132 -173.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.428 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 19.6 Cg_endo -74.93 81.18 2.25 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.871 2.381 . . . . 0.0 111.12 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.92 84.69 0.07 OUTLIER Glycine 0 C--O 1.223 -0.591 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.282 -178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.3 -63.48 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 O-C-N 125.164 1.155 . . . . 0.0 109.27 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.11 76.34 1.34 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 -177.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' ND2' HE22 ' A' ' 64' ' ' GLN . 2.9 p-10 -130.4 135.56 48.14 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.578 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.82 146.53 26.71 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.816 -0.553 . . . . 0.0 111.025 176.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -126.17 112.93 16.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.921 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -118.37 -79.54 0.6 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 123.487 0.492 . . . . 0.0 109.807 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.85 40.66 0.33 Allowed 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.659 0.742 . . . . 0.0 110.675 -178.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -170.2 86.01 0.12 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 122.083 0.944 . . . . 0.0 108.951 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -66.62 -19.91 65.88 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.549 -0.719 . . . . 0.0 110.9 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.752 HD13 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.402 HE22 ' ND2' ' A' ' 55' ' ' ASN . 9.2 tt0 -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.733 HE21 ' HG ' ' A' ' 29' ' ' SER . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.686 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.686 HG22 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.83 HG22 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.742 ' HG2' ' HZ1' ' A' ' 25' ' ' LYS . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.574 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.62 HD12 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.52 ' CE2' HG11 ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.574 HG21 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.527 ' N ' HG22 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.6 ' O ' HD22 ' A' ' 95' ' ' LEU . 1.9 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.605 ' CG1' HG13 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.505 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.886 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.886 HG23 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.684 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.503 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.402 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.752 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.697 HG23 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.609 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.597 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.46 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.675 HG22 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.859 ' HG3' HD23 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.697 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.675 ' HB3' HG22 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.528 HG21 ' H ' ' A' ' 123' ' ' ARG . 9.2 m -153.26 174.86 13.74 Favored 'General case' 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.528 ' H ' HG21 ' A' ' 122' ' ' THR . 1.4 ttt180 -52.39 92.98 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.557 1.143 . . . . 0.0 111.369 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 122' ' ' THR . 54.3 p -77.11 -60.23 2.45 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 115.952 -1.975 . . . . 0.0 106.574 -173.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 C--O 1.298 3.623 0 C-N-CA 127.289 2.236 . . . . 0.0 111.888 -173.802 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.3 71.92 0.6 Allowed 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.544 1.153 . . . . 0.0 109.918 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -57.92 98.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.106 -0.996 . . . . 0.0 111.686 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -161.66 101.18 1.17 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.724 0.773 . . . . 0.0 109.738 -175.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -136.19 146.12 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 171.33 164.92 0.09 Allowed 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 124.975 1.31 . . . . 0.0 110.109 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.48 98.64 2.67 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.777 -0.577 . . . . 0.0 110.02 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.3 90.55 0.1 OUTLIER Glycine 0 C--O 1.222 -0.631 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -141.97 -66.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.413 0.285 . . . . 0.0 111.515 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 -76.76 -69.53 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.055 0.542 . . . . 0.0 111.444 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.81 132.67 34.39 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.843 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.7 -41.3 19.95 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.083 178.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.52 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.54 1.536 . . . . 0.0 112.028 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 p -163.44 147.85 10.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.938 1.295 . . . . 0.0 108.846 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.3 t -58.99 -165.48 0.01 OUTLIER 'General case' 0 C--N 1.34 0.155 0 O-C-N 125.048 1.468 . . . . 0.0 111.266 174.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -37.63 -53.4 1.22 Allowed 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.333 -0.855 . . . . 0.0 113.047 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -172.44 45.06 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.27 1.028 . . . . 0.0 110.632 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -41.11 71.16 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.419 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.819 HG12 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.819 ' HB2' HG12 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.523 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.66 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.508 ' HG3' ' HG ' ' A' ' 39' ' ' SER . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t -145.0 -44.4 0.23 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 106.65 1.61 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.68 0.752 . . . . 0.0 110.157 -178.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.508 ' HG ' ' HG3' ' A' ' 36' ' ' GLN . 2.6 p -166.39 167.74 15.55 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.719 0.771 . . . . 0.0 109.809 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 -68.94 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.563 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.66 -175.57 0.53 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.565 1.946 . . . . 0.0 111.566 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.01 -155.03 0.11 Allowed 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.763 1.289 . . . . 0.0 111.092 175.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 66.1 p -70.23 107.93 3.94 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 125.561 1.545 . . . . 0.0 111.717 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 94.88 118.19 3.11 Favored Glycine 0 C--O 1.224 -0.507 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -176.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -156.98 68.98 0.57 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 122.55 1.167 . . . . 0.0 111.142 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 86.96 3.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 122.179 0.99 . . . . 0.0 110.384 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 8.6 t -83.14 47.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 122.33 1.062 . . . . 0.0 109.771 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.86 21.9 0.27 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.584 1.154 . . . . 0.0 111.658 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.74 22.28 0.27 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.9 -55.68 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 125.852 1.661 . . . . 0.0 111.799 -170.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.62 -91.78 0.01 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.46 2.774 . . . . 0.0 107.607 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.49 -57.48 0.19 Allowed Glycine 0 C--O 1.214 -1.143 0 CA-C-O 117.555 -1.691 . . . . 0.0 113.483 -174.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.34 -41.35 75.94 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 126.026 1.73 . . . . 0.0 112.757 175.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -48.8 156.28 0.5 Allowed 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 123.448 0.699 . . . . 0.0 111.6 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 56.59 93.1 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.694 0.759 . . . . 0.0 110.158 -168.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.42 162.19 0.16 Allowed 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.938 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -40.24 111.18 0.18 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.731 0.777 . . . . 0.0 112.759 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -158.17 150.6 22.18 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 122.006 0.908 . . . . 0.0 109.799 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.52 68.91 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 111.444 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.2 t -171.48 97.78 0.19 Allowed 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 120.083 -1.636 . . . . 0.0 109.276 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -63.84 -25.49 68.19 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.44 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' HG22 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.891 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.526 ' HA ' HG21 ' A' ' 124' ' ' THR . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.777 ' HG3' HG13 ' A' ' 73' ' ' VAL . 39.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.827 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.535 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.515 ' HZ1' ' HA ' ' A' ' 83' ' ' LYS . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.419 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.483 ' CD1' HG13 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.605 HD11 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.605 ' HA ' HD11 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.572 ' CG2' HD13 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.66 ' CB ' HD12 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.559 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.542 HD11 HD23 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.759 HG23 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.424 ' HG ' ' HG ' ' A' ' 63' ' ' LEU . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.457 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.891 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.759 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.495 ' HB3' HG22 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.489 ' H ' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p -93.88 143.54 26.25 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.11 173.24 2.24 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.526 HG21 ' HA ' ' A' ' 76' ' ' GLU . 15.8 p -145.77 107.51 4.29 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 104.019 -2.586 . . . . 0.0 104.019 -175.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . 0.316 1.0 OUTLIER . . . . . 0 C--O 1.276 2.469 0 CA-C-O 115.313 -2.28 . . . . 0.0 116.565 172.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -161.27 116.96 2.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -176.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.97 142.97 43.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.602 177.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.36 55.42 0.46 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 174.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -143.3 150.09 38.74 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.602 1.161 . . . . 0.0 108.86 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 168.01 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.563 1.545 . . . . 0.0 109.551 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.57 113.18 0.27 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 109.283 177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.39 -110.88 0.49 Allowed Glycine 0 C--O 1.226 -0.401 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -162.14 -55.77 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.504 0.669 . . . . 0.0 111.613 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.57 175.63 11.23 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 125.025 1.33 . . . . 0.0 110.599 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.91 111.27 6.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.789 1.235 . . . . 0.0 110.027 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.21 41.2 0.02 OUTLIER Glycine 0 N--CA 1.468 0.808 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.97 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -142.72 80.0 1.68 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 p -54.94 162.11 1.39 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.728 0.775 . . . . 0.0 111.344 172.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -178.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.587 172.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -35.19 -51.38 0.56 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -168.67 38.42 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.598 1.159 . . . . 0.0 110.653 171.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -57.35 12.97 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.753 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.518 ' N ' HD21 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.4 ' SG ' HD12 ' A' ' 27' ' ' LEU . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.446 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.564 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -146.32 -45.11 0.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.64 107.91 1.02 Allowed 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.747 -0.596 . . . . 0.0 109.55 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.9 t -150.5 175.29 12.02 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 124.217 1.007 . . . . 0.0 108.695 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 129.29 5.68 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 174.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 -43.29 133.96 3.93 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.086 0.954 . . . . 0.0 109.382 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.42 -165.3 0.14 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 126.036 2.085 . . . . 0.0 109.331 174.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.7 p -53.97 94.36 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.235 2.214 . . . . 0.0 111.276 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.2 -115.55 0.53 Allowed Glycine 0 C--O 1.222 -0.647 0 O-C-N 121.017 -1.052 . . . . 0.0 110.82 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -82.19 28.61 0.44 Allowed 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.554 176.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.6 ' HG2' HD22 ' A' ' 48' ' ' LEU . 5.7 tt0 -37.77 94.92 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.617 1.567 . . . . 0.0 112.735 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.9 t -83.77 49.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 123.077 1.418 . . . . 0.0 108.032 -172.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.6 HD22 ' HG2' ' A' ' 46' ' ' GLU . 0.3 OUTLIER -105.51 -23.17 12.85 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.119 1.768 . . . . 0.0 110.017 178.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.45 25.77 8.14 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 125.529 1.531 . . . . 0.0 112.861 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.3 mmt -109.78 86.83 5.01 Favored Pre-proline 0 C--N 1.327 -0.413 0 C-N-CA 124.915 1.286 . . . . 0.0 109.106 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.69 132.64 22.21 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.748 2.299 . . . . 0.0 108.19 177.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.69 90.09 0.27 Allowed Glycine 0 C--O 1.218 -0.848 0 N-CA-C 107.709 -2.156 . . . . 0.0 107.709 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -49.97 -31.65 13.09 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.89 1.345 . . . . 0.0 113.152 173.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.94 34.2 0.29 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 127.148 2.179 . . . . 0.0 113.411 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.459 ' OD1' ' HB3' ' A' ' 67' ' ' CYS . 27.0 m-20 -170.41 159.08 6.84 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 126.658 1.983 . . . . 0.0 109.639 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 95.27 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 176.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -119.09 62.82 0.79 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -173.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.74 -67.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.027 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -141.38 41.29 1.76 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 124.233 1.968 . . . . 0.0 111.192 -177.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.19 37.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.508 -1.37 . . . . 0.0 111.395 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.34 -14.57 4.76 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.002 HD22 ' HG ' ' A' ' 113' ' ' SER . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.459 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.591 HG13 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.753 HG22 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.562 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.552 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.622 ' SG ' HG21 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.581 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.429 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.581 HG21 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.494 ' H ' HG22 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.619 ' O ' HD22 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.421 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.803 HG23 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.564 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.778 HD11 HD13 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.636 HG23 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 1.002 ' HG ' HD22 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.47 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.511 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.555 HG22 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.591 ' NE ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.461 ' SG ' HG21 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.636 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.512 ' HD3' HG12 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.622 HG21 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p -79.9 130.78 35.58 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -141.82 52.01 1.51 Allowed 'General case' 0 C--O 1.219 -0.503 0 O-C-N 121.261 -0.9 . . . . 0.0 109.907 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 59.4 p -58.89 82.08 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.185 1.394 . . . . 0.0 110.397 177.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.306 -1.807 . . . . 0.0 112.113 -179.121 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -159.5 -41.54 0.05 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.887 0.742 . . . . 0.0 110.432 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -164.82 54.39 0.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 122.079 0.943 . . . . 0.0 110.988 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptp -157.33 164.91 37.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 121.671 -0.643 . . . . 0.0 110.906 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -150.68 171.91 16.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.305 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 172.7 135.79 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 123.563 0.539 . . . . 0.0 109.641 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -168.24 1.96 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.279 178.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.39 101.4 0.29 Allowed Glycine 0 C--O 1.218 -0.881 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -166.22 165.64 17.37 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 120.721 0.296 . . . . 0.0 110.635 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' CB ' ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -160.06 166.54 29.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.772 178.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -83.59 -170.39 3.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.773 1.296 . . . . 0.0 111.099 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.86 174.69 30.66 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.59 36.34 0.75 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 110.694 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -166.4 173.63 9.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.862 -0.524 . . . . 0.0 110.167 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 16' ' ' GLN . 13.2 m -53.44 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 124.42 1.075 . . . . 0.0 110.321 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' C ' ' O ' ' A' ' 15' ' ' SER . 43.0 tt0 -40.39 -54.13 2.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 121.92 -0.488 . . . . 0.0 110.982 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -177.38 39.0 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.749 0 O-C-N 124.498 1.124 . . . . 0.0 109.935 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -41.26 80.75 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.811 ' HA ' HG21 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.942 HD12 HG21 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.428 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.441 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.642 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.514 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.62 -151.69 0.15 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.8 t -134.06 106.99 7.5 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.254 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.1 p -147.59 -178.98 6.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.809 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -88.34 -169.32 2.51 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.503 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.551 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -179.84 145.71 0.23 Allowed 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 117.138 -1.411 . . . . 0.0 110.146 177.403 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.516 ' HA ' HG13 ' A' ' 47' ' ' VAL . 1.2 m -168.27 57.04 0.06 Allowed 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.717 2.511 . . . . 0.0 111.082 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.7 m -145.63 15.59 1.43 Allowed 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.661 0.743 . . . . 0.0 110.475 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -86.8 -123.6 1.64 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -87.02 -49.07 7.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.775 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -153.15 117.08 4.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.045 0.45 . . . . 0.0 110.271 -177.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.551 HG13 ' O ' ' A' ' 41' ' ' ARG . 3.4 t -150.71 62.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 121.913 0.863 . . . . 0.0 109.347 -177.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.481 HD11 ' O ' ' A' ' 48' ' ' LEU . 0.4 OUTLIER -156.62 31.39 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.926 0.87 . . . . 0.0 109.674 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -135.85 161.69 34.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.664 -0.647 . . . . 0.0 110.786 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.6 mtt -73.09 168.28 26.37 Favored Pre-proline 0 N--CA 1.441 -0.888 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.637 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -74.52 128.44 11.88 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.133 1.888 . . . . 0.0 111.648 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.84 -101.67 0.15 Allowed Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -55.86 -43.92 77.58 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 124.761 0.918 . . . . 0.0 110.714 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 55' ' ' ASN . 0.5 OUTLIER -56.13 -172.3 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 124.875 1.359 . . . . 0.0 110.264 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLU . 12.5 t30 -38.32 102.8 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 121.712 -0.617 . . . . 0.0 111.159 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.68 109.74 1.51 Allowed 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -175.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -170.23 145.81 2.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -41.1 -40.1 1.42 Allowed 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 124.783 1.302 . . . . 0.0 110.999 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 166.74 112.88 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 125.17 1.544 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -167.15 79.18 0.2 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.26 -15.16 22.33 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.514 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.827 ' CD2' ' HG ' ' A' ' 113' ' ' SER . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' NE2' ' HE ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.728 ' O ' HG22 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.428 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.942 HG21 HD12 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.88 HG13 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.417 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.447 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.88 ' HB3' HG13 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.719 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.473 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.445 ' CD2' ' O ' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.491 HD13 ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.551 ' HB3' ' HE2' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.911 ' HA ' HD11 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.603 ' O ' HD22 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.911 HD11 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.529 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.931 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.528 ' HB2' HG22 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.931 HG23 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.703 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.642 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.799 HD11 HD13 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.773 HG12 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.827 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.511 ' O ' HG23 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.495 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.773 ' HA ' HG12 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.675 ' HD2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.738 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.634 ' HB3' HG22 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.679 ' HB2' HG21 ' A' ' 116' ' ' VAL . 1.5 tt0 -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.593 HG21 ' H ' ' A' ' 123' ' ' ARG . 4.7 m -152.42 178.6 9.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.593 ' H ' HG21 ' A' ' 122' ' ' THR . 4.3 mtt180 -59.4 98.83 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.635 0.584 . . . . 0.0 111.123 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 122' ' ' THR . 19.0 p -91.3 -75.48 0.47 Allowed 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.82 0.7 . . . . 0.0 109.501 -178.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.417 ' OXT' ' HB3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.261 1.696 0 O-C-N 124.542 1.151 . . . . 0.0 110.279 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -140.73 -76.67 0.31 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.559 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 4' ' ' MET . 4.9 p90 -176.13 -163.04 0.1 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.058 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.434 ' N ' ' CD2' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -178.0 166.77 2.03 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 123.095 0.558 . . . . 0.0 111.209 177.248 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -152.81 178.34 9.76 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.442 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 170.73 147.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.637 0.732 . . . . 0.0 109.653 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.34 176.1 9.26 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.786 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -131.83 -113.93 1.55 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -168.92 144.82 3.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.992 0.425 . . . . 0.0 110.789 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.44 167.9 17.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 121.147 0.498 . . . . 0.0 110.562 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -147.26 -177.49 5.71 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.59 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 13' ' ' SER . . . 107.77 155.07 18.77 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 12' ' ' GLY . 0.5 OUTLIER 159.99 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.125 0.57 . . . . 0.0 110.516 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.602 ' HG ' ' HD2' ' A' ' 19' ' ' ARG . 31.1 p -166.77 -171.38 1.82 Allowed 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.424 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -56.02 -170.62 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.248 1.023 . . . . 0.0 108.827 -179.108 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.419 ' C ' ' O ' ' A' ' 15' ' ' SER . 50.0 tt0 -40.19 -61.25 0.91 Allowed 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.471 -0.768 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -178.28 40.48 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.985 0.897 . . . . 0.0 110.391 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' SG ' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -78.98 -28.85 43.58 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' HD2' ' HG ' ' A' ' 14' ' ' SER . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.746 HG21 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.746 ' OD2' HG21 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.885 HD22 ' HB2' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.587 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.526 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.772 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t -152.5 -42.77 0.1 Allowed 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -153.29 125.2 7.85 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.302 0.572 . . . . 0.0 109.863 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.6 -163.46 1.79 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.5 0.667 . . . . 0.0 110.214 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.4 ttm-85 -153.65 125.82 7.94 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 122.024 -0.422 . . . . 0.0 110.152 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.642 ' HG3' HG13 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -46.49 151.06 0.59 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.402 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.8 t -156.35 24.53 0.35 Allowed 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.043 0.84 . . . . 0.0 110.468 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 t -162.69 143.1 9.64 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.674 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.91 122.07 4.23 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -75.71 -4.28 39.49 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.63 68.56 0.72 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 122.551 1.167 . . . . 0.0 110.187 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.685 ' O ' HG11 ' A' ' 47' ' ' VAL . 47.2 t -142.26 60.36 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 122.985 1.374 . . . . 0.0 108.67 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -119.86 51.88 1.15 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 120.79 -1.194 . . . . 0.0 109.478 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -137.94 161.32 36.98 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.778 -0.576 . . . . 0.0 110.909 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.7 mmt -98.2 160.5 28.1 Favored Pre-proline 0 N--CA 1.44 -0.937 0 O-C-N 124.205 0.941 . . . . 0.0 112.118 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -72.0 132.58 20.04 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.726 2.284 . . . . 0.0 112.482 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.33 -82.76 0.41 Allowed Glycine 0 C--N 1.336 0.57 0 O-C-N 123.919 0.762 . . . . 0.0 111.199 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.448 ' O ' HD21 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -167.28 -77.58 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -110.61 119.1 38.04 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.458 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 20.8 t30 -74.24 61.76 0.89 Allowed 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.798 0.809 . . . . 0.0 109.639 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 57' ' ' GLN . 2.3 tt0 -108.87 -76.1 0.62 Allowed 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.067 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' N ' ' CG ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -111.86 -6.53 14.26 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.019 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.4 -156.83 0.64 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-O 121.198 0.523 . . . . 0.0 110.672 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.33 139.0 39.94 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-O 122.056 0.931 . . . . 0.0 111.004 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.513 ' HG ' ' HB2' ' A' ' 63' ' ' LEU . 12.2 t -166.74 74.34 0.16 Allowed 'General case' 0 C--O 1.199 -1.588 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.89 -22.48 2.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.883 -1.136 . . . . 0.0 110.664 178.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.526 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.086 HD13 HD11 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.458 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.654 ' SG ' HG21 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 1.03 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.407 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.645 HG22 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.414 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.574 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.753 ' SG ' HG22 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.885 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.602 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.436 ' HA ' ' CE ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.476 HG22 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.619 ' C ' HD11 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.509 ' N ' HD11 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.538 ' O ' HD22 ' A' ' 95' ' ' LEU . 4.2 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.636 ' HA ' HD22 ' A' ' 95' ' ' LEU . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.542 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.786 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.786 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.488 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.772 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.643 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 1.086 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.813 HG23 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.534 ' HB3' HD22 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.499 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 1.03 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.499 ' HB3' HG22 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.56 ' OE1' HG21 ' A' ' 124' ' ' THR . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.753 HG22 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m -154.59 -159.19 0.93 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.663 ' H ' HG21 ' A' ' 122' ' ' THR . 0.1 OUTLIER -49.1 118.83 2.86 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 122.644 0.377 . . . . 0.0 110.999 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.616 HG22 ' O ' ' A' ' 122' ' ' THR . 74.6 p -110.0 -40.89 4.61 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.65 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.548 0.887 0 O-C-N 125.295 1.622 . . . . 0.0 109.332 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.524 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -152.2 164.9 36.4 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.717 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -57.22 164.93 1.54 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.123 0.889 . . . . 0.0 112.109 177.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mtp -176.69 162.32 2.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.141 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -85.48 150.79 24.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.812 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 167.49 111.07 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 124.548 1.155 . . . . 0.0 110.138 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -141.4 141.99 33.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.842 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.71 -106.16 0.46 Allowed Glycine 0 C--O 1.219 -0.79 0 O-C-N 125.707 1.879 . . . . 0.0 109.555 -176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -148.47 -58.13 0.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.717 0.77 . . . . 0.0 110.052 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.06 -65.04 0.07 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 121.478 -0.764 . . . . 0.0 110.856 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.85 179.5 7.67 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.018 0.527 . . . . 0.0 111.096 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.61 145.68 4.58 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 t -92.94 -23.71 18.65 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.302 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.423 ' CB ' ' HG2' ' A' ' 80' ' ' GLU . 36.1 p -165.18 156.64 14.74 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 124.531 1.132 . . . . 0.0 109.293 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.478 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.3 OUTLIER -61.91 -154.98 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 123.176 1.465 . . . . 0.0 111.044 178.681 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -96.37 -21.99 17.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 119.541 -1.975 . . . . 0.0 111.302 176.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -177.25 34.84 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.568 ' O ' HG22 ' A' ' 22' ' ' VAL . 1.9 t -78.19 -24.38 47.18 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.508 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.681 ' HZ2' ' NH2' ' A' ' 74' ' ' ARG . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.474 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.795 ' CD1' HG21 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.424 ' HA ' HG23 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.642 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.76 HD12 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t -84.92 -46.82 10.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -142.55 -146.5 0.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -179.84 90.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 123.821 0.848 . . . . 0.0 109.489 -175.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -168.83 111.88 0.54 Allowed 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.823 -0.548 . . . . 0.0 109.747 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -176.65 171.05 2.34 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 123.681 0.613 . . . . 0.0 110.211 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 95.8 p -86.1 43.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.006 0.522 . . . . 0.0 111.334 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 41.4 m -70.75 -1.51 11.71 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.61 -0.681 . . . . 0.0 112.173 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.95 -119.83 3.35 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -162.25 -39.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.539 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -127.46 103.44 7.36 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.696 -178.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.0 88.78 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 177.11 -34.36 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.177 0 O-C-N 124.421 1.075 . . . . 0.0 109.892 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.29 2.32 7.07 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.374 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.572 ' HA ' ' HE1' ' A' ' 50' ' ' MET . 15.8 mmt -88.64 164.26 32.67 Favored Pre-proline 0 N--CA 1.433 -1.299 0 O-C-N 123.827 0.704 . . . . 0.0 112.403 179.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -75.53 52.96 3.41 Favored 'Trans proline' 0 C--O 1.241 0.659 0 C-N-CA 123.04 2.493 . . . . 0.0 111.606 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.14 -39.43 0.69 Allowed Glycine 0 N--CA 1.429 -1.772 0 CA-C-O 114.362 -3.465 . . . . 0.0 110.875 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -62.75 1.44 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 126.908 2.181 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -69.55 66.78 0.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 122.636 1.207 . . . . 0.0 110.613 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -85.95 -168.74 2.34 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.522 -1.361 . . . . 0.0 108.835 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.08 -71.0 0.09 Allowed 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 123.928 0.767 . . . . 0.0 112.095 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -115.49 130.01 56.74 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 124.116 0.885 . . . . 0.0 110.488 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.12 -54.17 39.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.15 0.5 . . . . 0.0 111.075 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.8 59.23 2.51 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 123.1 1.428 . . . . 0.0 111.049 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 p -166.04 40.51 0.06 Allowed 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 120.178 -1.576 . . . . 0.0 108.873 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -55.56 -20.38 13.14 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.916 HD13 HD11 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.662 ' SG ' HG21 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.795 HG21 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.474 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.681 ' NH2' ' HZ2' ' A' ' 25' ' ' LYS . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.559 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.467 ' CB ' HG13 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.423 ' HG2' ' CB ' ' A' ' 14' ' ' SER . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.838 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.577 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.508 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.838 HG21 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.402 ' O ' HD22 ' A' ' 95' ' ' LEU . 5.1 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.547 ' HA ' HD22 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.479 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.892 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.892 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.642 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.916 HD11 HD13 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.695 HG23 ' CB ' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.795 ' HB2' HD22 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.439 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.684 ' HA ' HG12 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.634 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.695 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.454 ' HB3' HG22 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.637 ' HG3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p -93.92 -153.77 0.38 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.86 -36.13 36.24 Favored 'General case' 0 C--O 1.211 -0.937 0 O-C-N 120.759 -1.213 . . . . 0.0 111.898 177.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.93 147.33 50.09 Favored 'General case' 0 CA--C 1.489 -1.378 0 O-C-N 124.603 1.189 . . . . 0.0 108.312 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.637 ' OXT' ' HG3' ' A' ' 121' ' ' GLN . 8.2 t30 . . . . . 0 CA--C 1.581 2.151 0 O-C-N 127.324 2.89 . . . . 0.0 111.671 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -149.74 -53.55 0.16 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 124.472 1.107 . . . . 0.0 110.459 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -166.95 119.91 0.98 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.91 0.862 . . . . 0.0 110.69 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.4 ptt? -115.64 133.53 55.94 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.358 -0.839 . . . . 0.0 110.785 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -178.33 170.51 1.72 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.0 p 172.0 137.88 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 123.546 0.529 . . . . 0.0 109.873 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -166.53 131.13 2.13 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -157.42 85.88 0.13 Allowed Glycine 0 C--O 1.222 -0.638 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.33 149.66 38.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.461 -0.199 . . . . 0.0 110.461 178.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.05 162.26 0.31 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.983 0.897 . . . . 0.0 110.375 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -81.81 117.88 22.45 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.396 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.46 100.44 0.26 Allowed Glycine 0 C--N 1.337 0.615 0 N-CA-C 110.304 -1.118 . . . . 0.0 110.304 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.46 72.36 0.83 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.093 0.473 . . . . 0.0 109.868 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.587 ' HG ' ' NE ' ' A' ' 19' ' ' ARG . 19.2 p -62.81 144.1 56.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.589 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -154.19 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 O-C-N 125.91 2.006 . . . . 0.0 110.432 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -46.04 62.08 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 118.846 -2.409 . . . . 0.0 110.707 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -177.42 45.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.703 0.627 . . . . 0.0 109.926 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.18 -35.8 81.5 Favored 'General case' 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.587 ' NE ' ' HG ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.493 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.694 HG21 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.492 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.493 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.694 ' CB ' HG21 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 81' ' ' ALA . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.472 ' SG ' HD11 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.615 ' OE1' HD13 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' CD2' HD13 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.757 HD12 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t -85.76 -71.44 0.54 Allowed 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 158.61 89.76 0.0 OUTLIER 'General case' 0 C--N 1.344 0.351 0 CA-C-O 122.196 0.998 . . . . 0.0 110.025 -177.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 m -163.1 -175.17 4.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.749 0.785 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.92 88.03 0.88 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.511 178.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -38.81 109.68 0.11 Allowed 'General case' 0 CA--C 1.529 0.166 0 O-C-N 124.734 1.271 . . . . 0.0 111.549 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.7 m -87.67 89.8 8.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -177.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.563 HG21 ' H ' ' A' ' 44' ' ' GLY . 3.7 m -93.06 -139.68 0.2 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.832 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.563 ' H ' HG21 ' A' ' 43' ' ' THR . . . -91.84 -115.15 2.05 Favored Glycine 0 C--O 1.219 -0.837 0 CA-C-O 122.722 1.179 . . . . 0.0 112.423 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -86.68 24.89 1.35 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.341 -1.682 . . . . 0.0 111.0 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -75.51 -148.73 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.477 -1.389 . . . . 0.0 110.939 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.469 ' O ' HG11 ' A' ' 47' ' ' VAL . 61.2 t -78.92 56.74 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-O 123.562 1.648 . . . . 0.0 108.882 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 44' ' ' GLY . 0.6 OUTLIER -140.29 37.36 1.9 Allowed 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 119.716 -1.865 . . . . 0.0 108.959 179.385 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -57.5 170.33 0.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 mtt -174.76 86.44 0.33 Allowed Pre-proline 0 C--N 1.327 -0.385 0 O-C-N 124.102 0.877 . . . . 0.0 111.1 178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.33 -20.09 28.25 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.527 1.484 . . . . 0.0 112.971 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.51 -78.54 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.425 0 CA-C-O 116.336 -2.369 . . . . 0.0 110.821 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -167.4 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 126.134 1.726 . . . . 0.0 109.494 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.95 62.32 1.6 Allowed 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.463 ' ND2' ' HA ' ' A' ' 61' ' ' GLN . 7.5 p30 36.97 -158.53 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.326 1.536 . . . . 0.0 111.236 -177.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -110.26 66.95 0.63 Allowed 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 171.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.7 tp60 -159.95 163.43 34.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -46.86 -57.69 4.67 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 124.173 0.92 . . . . 0.0 110.718 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -169.84 83.44 0.12 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.246 1.022 . . . . 0.0 109.862 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 176.95 94.52 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.23 1.014 . . . . 0.0 109.438 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.463 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 2.2 pt20 -66.16 -30.33 70.79 Favored 'General case' 0 CA--C 1.52 -0.175 0 O-C-N 121.539 -0.725 . . . . 0.0 111.074 178.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.845 HD12 ' HG ' ' A' ' 113' ' ' SER . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.847 ' O ' HG22 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.847 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.412 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.438 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.462 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.453 ' HB3' ' CG ' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.432 ' HG3' ' CB ' ' A' ' 14' ' ' SER . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.619 ' HB2' HD21 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.59 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.43 ' O ' HD12 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.444 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.543 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.604 ' HA ' HD22 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.52 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.635 ' N ' HD21 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.623 HG23 HD11 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.757 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.746 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.426 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.74 HG22 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.88 HG23 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.845 ' HG ' HD12 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.588 ' O ' HG23 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.501 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.675 ' HA ' HG12 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.617 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.88 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.546 ' CD ' HG11 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.641 HG21 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -94.61 -153.79 0.4 Allowed 'General case' 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.641 ' H ' HG21 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.07 -29.43 69.21 Favored 'General case' 0 C--O 1.209 -1.058 0 O-C-N 119.866 -1.771 . . . . 0.0 111.391 178.198 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -139.95 122.02 15.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.248 -0.882 . . . . 0.0 109.852 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.7 t30 . . . . . 0 C--O 1.254 1.306 0 O-C-N 125.525 1.766 . . . . 0.0 111.924 177.822 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.62 0 CA-C-O 117.738 -1.125 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -160.11 -50.76 0.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 125.27 1.606 . . . . 0.0 109.793 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -158.37 -178.96 7.67 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 120.989 -1.069 . . . . 0.0 109.12 -177.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -39.91 102.89 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.603 1.161 . . . . 0.0 111.708 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 175.79 158.55 0.24 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 124.116 0.885 . . . . 0.0 109.863 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.2 111.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.719 0.808 . . . . 0.0 109.897 -178.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.31 119.49 11.45 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.69 -92.16 0.01 OUTLIER Glycine 0 CA--C 1.531 1.056 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.28 132.42 47.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.143 0.973 . . . . 0.0 110.235 178.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.93 162.41 6.99 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.809 177.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.15 178.96 7.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.514 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.39 92.27 0.02 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 123.976 0.798 . . . . 0.0 111.522 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -90.21 54.6 2.82 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.4 p -163.53 149.15 11.32 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 t -59.77 -164.82 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 O-C-N 124.178 0.924 . . . . 0.0 110.587 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -39.56 -47.08 1.86 Allowed 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -175.6 44.78 0.01 OUTLIER 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.78 1.276 . . . . 0.0 110.352 175.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.9 -55.45 10.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.664 HG21 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.664 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.916 HD23 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' HB3' HG23 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.671 ' OE2' HD13 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.49 ' CE1' ' HB3' ' A' ' 38' ' ' SER . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.671 HD13 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m -86.28 -179.63 6.73 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.49 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 7.5 p -125.15 115.46 20.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.377 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 t -165.22 132.68 3.02 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.99 144.63 52.96 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -172.07 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 124.143 0.902 . . . . 0.0 111.945 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 85.2 p -60.92 76.17 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.896 1.331 . . . . 0.0 113.68 175.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 p -142.82 140.69 31.42 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 120.1 -1.625 . . . . 0.0 107.782 -173.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.15 -114.22 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -149.84 49.51 0.93 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 122.372 1.082 . . . . 0.0 110.432 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -140.19 35.63 1.9 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 123.141 1.448 . . . . 0.0 109.895 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.501 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -88.08 28.39 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 O-C-N 120.602 -1.311 . . . . 0.0 110.0 178.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.41 -16.24 22.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.956 0.884 . . . . 0.0 111.207 179.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.88 137.23 38.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.333 -0.855 . . . . 0.0 111.079 175.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 171.86 6.71 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.933 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -74.06 54.16 3.1 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.953 3.102 . . . . 0.0 112.192 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.41 -91.82 0.12 Allowed Glycine 0 C--O 1.221 -0.684 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.02 -55.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.994 1.055 . . . . 0.0 109.15 -178.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.53 106.95 17.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -113.8 27.39 9.57 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 111.043 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.86 -178.03 3.53 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 123.601 0.76 . . . . 0.0 109.621 -178.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -165.59 -69.86 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 110.576 176.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -122.13 177.66 5.25 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.435 0.694 . . . . 0.0 110.321 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.72 87.27 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.593 0.757 . . . . 0.0 111.643 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.471 ' CB ' HD21 ' A' ' 63' ' ' LEU . 0.8 OUTLIER 169.87 76.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.454 1.102 . . . . 0.0 108.304 -175.291 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -55.8 -26.74 47.66 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.669 -0.645 . . . . 0.0 110.817 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.469 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.761 HD13 HD11 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.583 ' O ' HG22 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.439 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.52 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.754 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HD2' HG21 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.511 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.454 HD12 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.754 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.466 ' HA ' HD11 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.594 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.718 HG13 HG13 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.503 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.811 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.811 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.637 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.779 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.414 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.761 HD11 HD13 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.824 HG23 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.709 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.562 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.747 HG22 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.916 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.413 ' H ' ' HB2' ' A' ' 117' ' ' ARG . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.824 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.747 ' HB3' HG22 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.587 ' HB2' HG21 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.719 ' O ' HG22 ' A' ' 124' ' ' THR . 7.1 p -154.84 -178.44 7.21 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -44.62 100.38 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.465 0.706 . . . . 0.0 112.091 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 122' ' ' THR . 11.9 p -118.28 -86.06 0.64 Allowed 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 116.227 -1.844 . . . . 0.0 107.032 -171.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 57.1 t30 . . . . . 0 CA--C 1.541 0.598 0 O-C-N 126.093 2.12 . . . . 0.0 111.129 -176.869 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.86 -62.93 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.364 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.2 132.04 52.67 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.205 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 ttt -74.25 55.26 0.59 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 121.742 0.782 . . . . 0.0 111.24 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -136.52 168.26 19.82 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.518 -0.739 . . . . 0.0 110.029 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 170.12 105.04 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.785 0.802 . . . . 0.0 109.63 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -148.27 35.27 0.81 Allowed 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.898 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.22 -83.12 0.06 OUTLIER Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.2 129.68 15.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.641 0.734 . . . . 0.0 110.347 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -159.7 165.01 33.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.266 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.95 71.74 6.67 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.036 0.922 . . . . 0.0 110.046 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.92 41.03 2.26 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -87.98 -59.81 2.14 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.505 0.669 . . . . 0.0 109.831 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 19' ' ' ARG . 12.1 p -168.73 169.08 10.28 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.374 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.5 173.42 0.39 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 -177.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -44.88 -49.41 10.95 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.316 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.454 ' O ' ' CG ' ' A' ' 20' ' ' GLN . 3.4 tt0 -175.04 34.3 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.503 ' HB3' HG22 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.46 -22.41 44.15 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 14' ' ' SER . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.454 ' CG ' ' O ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.566 HG11 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.409 ' N ' ' HG ' ' A' ' 28' ' ' SER . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.7 ' CB ' HG22 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.907 HD23 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.409 ' HG ' ' N ' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.447 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.834 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.12 -53.35 4.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -166.16 98.24 0.62 Allowed 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.0 m -38.93 102.46 0.02 OUTLIER 'General case' 0 C--O 1.209 -1.048 0 O-C-N 123.921 0.763 . . . . 0.0 111.328 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.52 123.75 0.67 Allowed 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 120.873 -1.142 . . . . 0.0 109.728 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 178.91 138.31 0.09 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.573 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.419 ' HA ' HD12 ' A' ' 48' ' ' LEU . 1.7 m -88.96 93.44 9.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.921 0.763 . . . . 0.0 110.269 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.627 ' OG1' HD21 ' A' ' 48' ' ' LEU . 71.4 p -93.17 -138.56 0.2 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.565 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.75 ' O ' HD23 ' A' ' 48' ' ' LEU . . . -94.0 -122.74 3.57 Favored Glycine 0 N--CA 1.438 -1.191 0 CA-C-O 121.903 0.724 . . . . 0.0 111.922 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -86.38 27.28 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.712 0.768 . . . . 0.0 110.761 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.32 -147.64 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 123.105 1.431 . . . . 0.0 110.936 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.636 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -89.47 36.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 120.493 -1.38 . . . . 0.0 109.795 178.883 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.75 HD23 ' O ' ' A' ' 44' ' ' GLY . 0.8 OUTLIER -110.21 13.89 22.95 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 120.356 -1.465 . . . . 0.0 109.822 179.349 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -98.87 28.35 4.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 C-N-CA 122.835 0.454 . . . . 0.0 110.575 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 mtt -165.39 80.27 1.2 Allowed Pre-proline 0 N--CA 1.444 -0.772 0 CA-C-O 121.274 0.559 . . . . 0.0 110.937 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -71.78 54.41 2.04 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.543 2.162 . . . . 0.0 112.775 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.39 110.12 2.41 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -172.12 -64.44 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.504 0.669 . . . . 0.0 109.538 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -109.86 104.25 13.16 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.28 1.038 . . . . 0.0 108.409 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 175.05 1.01 Allowed 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.436 178.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.19 138.4 2.23 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 124.002 0.814 . . . . 0.0 110.836 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -66.81 71.88 0.09 Allowed 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 123.924 0.765 . . . . 0.0 109.977 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -179.14 126.72 0.09 Allowed 'General case' 0 N--CA 1.426 -1.642 0 C-N-CA 123.454 0.702 . . . . 0.0 110.051 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -45.37 107.57 0.1 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.522 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.3 p -174.77 68.44 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 122.036 0.922 . . . . 0.0 108.815 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -61.9 -14.02 30.29 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.847 -0.533 . . . . 0.0 110.064 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.531 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.9 mm100 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.78 HD13 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.653 ' O ' HG22 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 2.5 mm100 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.794 HG21 HD12 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.733 HG23 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.733 ' HA ' HG23 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.486 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.556 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.566 ' CD2' HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.834 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.515 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.471 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.645 ' HA ' HD22 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.805 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.423 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.422 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.805 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.692 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.615 ' HB3' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.78 ' CD1' HD13 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.639 HG23 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.746 ' CB ' HD22 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.522 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.635 ' HA ' HG12 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.486 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.639 ' HB3' HG23 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p -91.66 -153.19 0.32 Allowed 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -69.95 -92.91 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.425 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.478 ' O ' HG22 ' A' ' 124' ' ' THR . 2.5 t -58.46 92.61 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.779 0.832 . . . . 0.0 110.931 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.248 0.988 0 O-C-N 124.47 1.106 . . . . 0.0 110.556 -177.996 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.135 0 CA-C-O 115.871 -2.014 . . . . 0.0 106.118 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -172.68 3.94 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 124.867 1.355 . . . . 0.0 109.758 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -159.93 57.46 0.37 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 112.054 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptm -178.26 135.73 0.16 Allowed 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 120.85 -1.156 . . . . 0.0 109.046 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 176.8 174.36 0.4 Allowed 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 124.201 1.0 . . . . 0.0 108.73 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.0 p 173.01 91.42 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.116 1.367 . . . . 0.0 110.437 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -139.92 179.9 6.33 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.796 -1.19 . . . . 0.0 110.655 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -140.74 -111.68 0.92 Allowed Glycine 0 CA--C 1.51 -0.251 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -161.5 151.72 17.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 123.655 0.782 . . . . 0.0 110.025 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -65.34 160.61 21.39 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.282 0.364 . . . . 0.0 111.351 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.3 157.68 30.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.183 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 53.54 81.24 0.06 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.846 0.736 . . . . 0.0 112.543 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.5 t -155.43 46.64 0.5 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.406 1.098 . . . . 0.0 109.412 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.717 ' HG ' ' HB2' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -56.43 157.89 4.72 Favored 'General case' 0 CA--C 1.523 -0.089 0 O-C-N 121.151 -0.968 . . . . 0.0 110.371 176.068 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -162.65 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.848 0.859 . . . . 0.0 111.103 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -36.49 -60.42 0.59 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -164.04 50.22 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 124.251 1.977 . . . . 0.0 107.268 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -78.93 -40.57 31.69 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.717 ' HB2' ' HG ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.481 HG23 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.637 ' HA ' ' HG ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.542 ' OD1' HG12 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.615 HD12 HG21 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.637 ' HG ' ' HA ' ' A' ' 24' ' ' ARG . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.481 ' SG ' HD11 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' OE1' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.674 HD12 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t -89.38 -156.01 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.6 p -99.55 -179.49 4.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.355 1.074 . . . . 0.0 111.326 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.56 -166.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.119 1.368 . . . . 0.0 109.958 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt-85 -169.84 -45.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.928 0.891 . . . . 0.0 110.861 175.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -56.48 140.47 45.94 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.626 0.77 . . . . 0.0 109.414 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.3 t -169.41 133.4 1.35 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 t -64.12 139.71 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.398 0.618 . . . . 0.0 111.526 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.06 -117.61 0.41 Allowed Glycine 0 C--O 1.225 -0.453 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 177.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -148.82 -55.45 0.19 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.678 0.791 . . . . 0.0 110.455 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -143.55 102.33 3.92 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 122.465 1.126 . . . . 0.0 108.479 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 p -140.17 20.03 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.779 1.276 . . . . 0.0 110.752 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 pp -106.64 -13.79 15.2 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.322 -0.861 . . . . 0.0 112.405 178.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.53 12.66 1.73 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.498 1.119 . . . . 0.0 113.355 175.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.71 88.15 0.93 Allowed Pre-proline 0 C--O 1.22 -0.468 0 O-C-N 123.877 0.735 . . . . 0.0 110.333 -176.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -71.39 -14.82 31.19 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 120.995 1.13 . . . . 0.0 112.932 176.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.77 -91.01 0.2 Allowed Glycine 0 C--O 1.224 -0.48 0 C-N-CA 125.601 1.572 . . . . 0.0 109.881 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -163.65 -55.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.233 1.013 . . . . 0.0 110.319 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -104.2 113.33 26.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.476 1.111 . . . . 0.0 109.546 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -166.31 131.62 2.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.395 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -72.21 161.06 31.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.496 -0.753 . . . . 0.0 112.089 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -163.29 83.17 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.558 0.694 . . . . 0.0 110.115 177.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.11 -73.07 0.15 Allowed 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.928 -0.483 . . . . 0.0 110.229 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -124.97 21.48 8.17 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.56 1.544 . . . . 0.0 111.183 -177.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.741 ' HB2' HD21 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -172.88 57.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 124.08 1.895 . . . . 0.0 109.02 -173.15 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -68.04 -22.44 64.95 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 119.64 -1.913 . . . . 0.0 111.332 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.77 ' O ' HG22 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.77 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.566 HG21 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.566 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.481 ' HB3' HG23 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.679 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.447 HD12 ' HA ' ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.477 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.679 HG21 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.6 ' H ' HG22 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.437 ' HA ' HD11 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD22 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.636 HG13 HG13 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.424 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.775 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.486 ' HB2' HG22 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.775 HG23 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.674 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 1.087 HD11 HD13 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.787 HG23 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.787 ' HG ' ' HB3' ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG12 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.438 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.787 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.571 ' CG ' HG12 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p -95.69 -162.4 0.95 Allowed 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -37.03 -85.97 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -56.06 158.94 3.6 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.068 0.947 . . . . 0.0 111.604 172.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.6 t30 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.116 -1.897 . . . . 0.0 113.12 170.788 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.696 0 CA-C-O 117.847 -1.073 . . . . 0.0 108.547 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -165.18 136.08 3.93 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.862 1.351 . . . . 0.0 109.668 -179.111 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -161.0 167.76 25.85 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.14 155.7 0.08 Allowed 'General case' 0 C--O 1.233 0.189 0 O-C-N 124.418 1.074 . . . . 0.0 112.607 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -86.61 177.77 7.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 166.64 103.11 0.0 OUTLIER 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.528 0.731 . . . . 0.0 110.12 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.42 -172.8 4.17 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 110.526 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.33 -112.08 3.4 Favored Glycine 0 C--O 1.224 -0.519 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -159.39 155.95 27.61 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -161.66 160.96 29.32 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.36 165.22 28.1 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.527 0.517 . . . . 0.0 111.247 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 136.34 100.12 0.58 Allowed Glycine 0 C--O 1.224 -0.503 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 t -177.62 102.35 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.534 ' HG ' ' HD2' ' A' ' 19' ' ' ARG . 41.7 t -170.14 -153.66 0.1 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.44 1.096 . . . . 0.0 108.886 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.58 -153.26 0.15 Allowed 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.589 176.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.97 -53.9 15.68 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.627 0.727 . . . . 0.0 111.042 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.18 41.54 0.27 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.549 1.166 . . . . 0.0 109.375 -178.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -78.6 -59.63 2.7 Favored 'General case' 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.534 ' HD2' ' HG ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.834 ' HA ' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.624 ' H ' HD21 ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.549 ' HG ' ' HB3' ' A' ' 65' ' ' GLN . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.513 ' SG ' HD11 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.574 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.74 ' HH ' ' NE2' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.596 HD12 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.07 -154.17 0.29 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.7 p -78.28 112.48 15.32 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.566 -0.709 . . . . 0.0 111.046 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.457 ' HG ' ' HG2' ' A' ' 65' ' ' GLN . 9.7 t -41.93 132.28 3.15 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.718 0.407 . . . . 0.0 110.929 178.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -147.52 69.47 1.15 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -177.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 ttt-85 -176.92 129.37 0.17 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.673 -0.68 . . . . 0.0 110.027 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.98 145.93 2.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.377 1.048 . . . . 0.0 109.395 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 45.1 m -77.33 146.6 36.66 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 123.487 0.492 . . . . 0.0 110.677 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.61 123.6 3.65 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.84 -50.44 66.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.913 0.387 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.48 59.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.146 0.974 . . . . 0.0 110.459 179.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.2 p -89.47 23.01 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.731 0.777 . . . . 0.0 111.286 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mp -124.4 50.3 1.71 Allowed 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.631 0.729 . . . . 0.0 109.643 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.67 159.43 24.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.836 178.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 mmm -42.74 148.15 0.58 Allowed Pre-proline 0 CA--C 1.54 0.563 0 O-C-N 124.029 0.831 . . . . 0.0 112.935 178.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -70.65 125.23 11.46 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 N-CA-C 108.896 -1.232 . . . . 0.0 108.896 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.7 92.48 1.37 Allowed Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.96 -52.74 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 O-C-N 125.01 1.065 . . . . 0.0 109.067 -178.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -108.04 43.18 1.24 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 121.746 0.784 . . . . 0.0 110.543 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -177.11 167.62 2.41 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.082 -1.011 . . . . 0.0 108.93 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -57.46 -80.51 0.02 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 O-C-N 124.059 0.849 . . . . 0.0 112.419 175.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -127.48 159.1 35.58 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.672 0.748 . . . . 0.0 111.314 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.99 95.57 9.56 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.036 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -179.55 31.5 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.846 0.716 . . . . 0.0 111.395 -176.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.5 p 170.74 85.62 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.969 0.89 . . . . 0.0 109.642 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -57.58 -21.17 37.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.74 ' NE2' ' HH ' ' A' ' 33' ' ' TYR . 2.2 mp0 -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.952 HD13 HD11 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HB3' ' HG ' ' A' ' 29' ' ' SER . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.86 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.86 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.834 HG22 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.704 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.652 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.609 ' HG3' HG13 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.678 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.71 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.445 HG23 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.71 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.569 HD13 HG22 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.486 ' OE2' HD12 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.596 ' HG2' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.648 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.405 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.952 HD11 HD13 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.757 HG12 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.552 ' HB2' HD22 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.499 ' O ' HG23 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.451 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.91 HG22 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.573 ' HD3' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.696 ' HB3' HG13 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.91 ' HB3' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.675 ' HB2' HG21 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.507 HG21 ' H ' ' A' ' 123' ' ' ARG . 2.2 m -141.58 -147.55 0.22 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.507 ' H ' HG21 ' A' ' 122' ' ' THR . 0.0 OUTLIER -36.06 -66.54 0.2 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.332 1.053 . . . . 0.0 110.874 179.685 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.78 140.74 52.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.358 1.036 . . . . 0.0 109.24 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.655 174.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.84 138.8 32.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.515 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -52.23 131.61 32.79 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.15 0.976 . . . . 0.0 111.041 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.0 ptp -145.62 164.16 32.58 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.667 -0.646 . . . . 0.0 110.658 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.84 174.38 0.62 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.718 1.247 . . . . 0.0 110.433 178.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.58 155.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.029 -1.044 . . . . 0.0 109.282 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mttt -67.25 120.44 13.8 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -155.96 82.44 0.16 Allowed Glycine 0 C--O 1.222 -0.623 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.24 -36.86 14.49 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 124.046 0.498 . . . . 0.0 110.779 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 162.68 0.83 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.367 0.604 . . . . 0.0 110.142 178.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.87 170.55 7.84 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.762 177.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.81 171.15 27.12 Favored Glycine 0 CA--C 1.502 -0.731 0 CA-C-O 116.713 -2.159 . . . . 0.0 111.764 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 160.3 122.45 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.8 0 O-C-N 126.764 2.096 . . . . 0.0 109.83 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.4 p -65.51 135.26 54.92 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 117.158 -1.401 . . . . 0.0 108.336 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.449 ' O ' ' C ' ' A' ' 16' ' ' GLN . 6.0 t -55.1 180.0 0.02 OUTLIER 'General case' 0 C--O 1.24 0.584 0 O-C-N 126.323 2.265 . . . . 0.0 108.854 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.449 ' C ' ' O ' ' A' ' 15' ' ' SER . 20.1 tt0 -42.02 -54.18 3.62 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.075 -1.016 . . . . 0.0 110.136 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 31.8 mt-30 -155.02 56.94 0.66 Allowed 'General case' 0 N--CA 1.439 -0.985 0 O-C-N 123.722 0.639 . . . . 0.0 110.244 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -53.02 6.56 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HG2' ' N ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.469 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' N ' HE21 ' A' ' 20' ' ' GLN . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.666 HG23 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.489 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.482 ' HZ1' ' HD3' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.665 ' HA ' HG21 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.838 ' H ' HD21 ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.605 ' CD ' ' HB3' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.492 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t -143.86 -159.49 0.99 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.2 p -45.53 116.78 1.24 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.808 0.813 . . . . 0.0 110.748 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.7 p -176.2 104.16 0.07 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 122.753 1.263 . . . . 0.0 109.795 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 -61.05 -172.43 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 O-C-N 120.752 -1.217 . . . . 0.0 110.912 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.95 175.49 0.06 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.79 174.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -89.24 -150.67 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.441 1.115 . . . . 0.0 109.737 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.8 p -79.15 98.82 6.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 123.76 1.743 . . . . 0.0 110.512 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.38 -119.23 0.7 Allowed Glycine 0 C--O 1.222 -0.596 0 O-C-N 119.612 -1.93 . . . . 0.0 110.998 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -150.26 -65.97 0.2 Allowed 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.987 0.463 . . . . 0.0 110.606 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.98 -156.87 0.74 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.614 ' O ' HG11 ' A' ' 47' ' ' VAL . 75.9 t -145.44 31.33 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-O 122.281 1.038 . . . . 0.0 109.805 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 38.4 mt -117.85 26.45 9.67 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.258 -0.901 . . . . 0.0 109.548 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.5 149.97 31.32 Favored 'General case' 0 C--O 1.216 -0.69 0 O-C-N 121.019 -1.051 . . . . 0.0 109.104 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.402 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 3.2 mtm -42.17 -51.28 10.75 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.576 173.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 28.9 Cg_endo -73.75 57.06 3.64 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.049 2.499 . . . . 0.0 112.197 176.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 121.31 89.08 1.03 Allowed Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -166.77 -74.08 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.644 0.85 . . . . 0.0 109.892 178.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -63.99 85.85 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 124.548 1.155 . . . . 0.0 108.254 -177.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.418 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 8.7 t30 -137.94 120.57 16.21 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 -176.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.16 97.46 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 125.602 1.814 . . . . 0.0 112.14 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -169.65 130.45 1.05 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -75.82 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.302 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -135.03 72.0 1.45 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.584 1.183 . . . . 0.0 108.932 -176.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 t -166.66 74.88 0.17 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 122.974 1.369 . . . . 0.0 108.254 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -67.7 -8.28 33.9 Favored 'General case' 0 C--O 1.219 -0.517 0 O-C-N 120.153 -1.592 . . . . 0.0 110.497 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.908 HD13 HD11 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.418 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.633 ' O ' HG22 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.86 HG13 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.482 ' HD3' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.666 ' HB3' HG23 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.402 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 4.1 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.579 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.493 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.579 HG21 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.72 ' HB3' ' HE3' ' A' ' 119' ' ' MET . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.613 ' O ' HD22 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.659 HG13 HG13 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.498 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.701 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.438 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.701 HG23 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.539 ' HA ' ' HE1' ' A' ' 119' ' ' MET . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.438 ' NE2' ' HA ' ' A' ' 102' ' ' ARG . 17.1 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.722 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.746 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.908 HD11 HD13 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.746 HG22 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.72 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.403 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.484 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.635 HG12 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.86 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.72 ' HE3' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.635 ' HD3' HG12 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.568 ' OE1' HG23 ' A' ' 124' ' ' THR . 2.9 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.726 HG21 ' H ' ' A' ' 123' ' ' ARG . 6.3 m -140.3 -172.87 3.52 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.726 ' H ' HG21 ' A' ' 122' ' ' THR . 0.5 OUTLIER -39.54 138.94 0.63 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.882 1.363 . . . . 0.0 110.759 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' THR . . . . . 0.568 HG23 ' OE1' ' A' ' 121' ' ' GLN . 19.7 p -129.02 -37.88 1.67 Allowed 'General case' 0 C--N 1.312 -1.034 0 O-C-N 124.246 0.966 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.259 1.581 1 CA-C-O 110.92 -4.372 . . . . 0.0 110.035 -176.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.714 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -161.97 77.32 0.51 Allowed 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 123.948 0.78 . . . . 0.0 110.821 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.75 86.88 0.11 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.42 0.629 . . . . 0.0 110.81 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 mtp -81.43 78.87 8.15 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 121.339 -0.851 . . . . 0.0 110.513 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -94.82 177.18 5.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.9 p 172.7 167.69 0.12 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.401 1.096 . . . . 0.0 110.017 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -141.16 48.65 1.67 Allowed 'General case' 0 N--CA 1.456 -0.125 0 CA-C-O 122.092 0.949 . . . . 0.0 110.985 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -171.25 59.62 0.17 Allowed Glycine 0 CA--C 1.509 -0.302 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.7 158.78 29.28 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.753 177.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.8 157.83 0.05 OUTLIER 'General case' 0 C--N 1.346 0.422 0 CA-C-O 121.944 0.878 . . . . 0.0 111.275 179.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -83.76 109.6 17.64 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.514 -0.741 . . . . 0.0 110.746 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.64 66.41 0.01 OUTLIER Glycine 0 C--N 1.332 0.32 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.7 t -58.79 -62.5 1.83 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.467 0.307 . . . . 0.0 110.708 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.8 p -65.12 -159.82 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 122.196 0.998 . . . . 0.0 112.037 176.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.63 -176.48 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.583 -0.698 . . . . 0.0 111.688 175.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -42.22 -53.98 3.86 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -165.6 38.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.544 1.164 . . . . 0.0 110.721 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.663 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -65.54 -47.39 76.05 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.664 ' HB3' HG22 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.865 HD12 HG21 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.632 ' OE2' ' HB1' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.414 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.759 HD12 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.6 ' NE2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.6 ' H ' ' NE2' ' A' ' 36' ' ' GLN . 1.7 t -161.56 35.29 0.13 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.6 p -148.05 -173.07 4.21 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 120.188 -1.57 . . . . 0.0 111.291 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.8 p -83.57 -173.48 4.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.192 0.996 . . . . 0.0 112.412 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -85.41 109.78 18.68 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.339 -0.851 . . . . 0.0 109.555 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.39 176.77 0.08 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.28 0.562 . . . . 0.0 111.748 176.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 m -78.39 57.61 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.943 0.878 . . . . 0.0 111.562 178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.7 p -93.57 99.42 11.88 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.049 -1.032 . . . . 0.0 108.754 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 92.32 118.47 2.47 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.56 -24.64 64.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.89 0.376 . . . . 0.0 111.282 177.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -113.82 61.51 0.66 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 123.122 1.439 . . . . 0.0 110.01 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.443 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.6 OUTLIER -87.8 22.04 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.103 0 O-C-N 120.624 -1.298 . . . . 0.0 111.255 178.206 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.4 51.64 1.2 Allowed 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 122.455 1.121 . . . . 0.0 109.686 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.97 28.25 0.61 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.19 -0.944 . . . . 0.0 112.153 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.05 161.49 51.33 Favored Pre-proline 0 N--CA 1.439 -1.02 0 O-C-N 121.536 -0.727 . . . . 0.0 111.354 -177.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -72.27 -8.91 23.59 Favored 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.763 1.642 . . . . 0.0 112.497 175.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.58 84.6 0.02 OUTLIER Glycine 0 C--N 1.348 1.227 0 O-C-N 125.07 1.481 . . . . 0.0 111.348 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 177.32 -44.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 122.153 0.978 . . . . 0.0 109.124 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.34 65.07 0.71 Allowed 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.037 0.922 . . . . 0.0 109.955 -178.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -172.92 46.02 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.687 -0.633 . . . . 0.0 111.194 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 -176.8 3.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.734 0.778 . . . . 0.0 110.089 -177.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 tm0? -157.58 -70.68 0.1 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 121.972 -0.455 . . . . 0.0 110.231 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -178.8 -74.98 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.633 0.773 . . . . 0.0 110.458 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -137.03 76.67 1.6 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.862 0.839 . . . . 0.0 109.957 -177.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . 0.976 ' HG ' HD12 ' A' ' 63' ' ' LEU . 28.6 t -176.27 96.33 0.06 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.936 0.874 . . . . 0.0 109.575 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.66 -28.15 65.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.618 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.414 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.09 HD13 HD11 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.719 ' O ' HG22 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.865 HG21 HD12 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.409 ' N ' HG12 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.509 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.403 ' HA ' ' HB2' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.836 ' O ' HG21 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.483 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.836 HG21 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.632 ' HB1' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.689 ' HA ' HD11 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD22 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.689 HD11 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.46 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.921 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.432 ' HB2' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.921 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.462 ' O ' ' HE3' ' A' ' 119' ' ' MET . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.759 ' CB ' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.593 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.427 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 1.09 HD11 HD13 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.723 HG23 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.627 ' HG ' HD23 ' A' ' 63' ' ' LEU . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.433 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.508 ' HD2' HG12 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.723 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.591 ' HB3' HG12 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.634 HG21 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -143.18 -155.46 0.6 Allowed 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.634 ' H ' HG21 ' A' ' 122' ' ' THR . 37.8 mtt180 -41.73 149.24 0.13 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.772 1.229 . . . . 0.0 112.041 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.0 p -147.22 -44.0 0.17 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 117.051 -1.452 . . . . 0.0 109.817 -173.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 . . . . . 0 C--O 1.258 1.534 0 CA-C-O 115.068 -2.396 . . . . 0.0 111.386 -175.324 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.484 ' N ' ' OD2' ' A' ' 75' ' ' ASP . . . . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.58 141.94 6.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -166.09 105.71 0.68 Allowed 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 123.841 0.713 . . . . 0.0 110.02 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 tmm? -91.77 100.02 12.8 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.887 -0.508 . . . . 0.0 110.117 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -148.84 171.78 15.73 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.782 0.433 . . . . 0.0 110.071 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.82 152.52 0.11 Allowed 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.03 0.932 . . . . 0.0 109.809 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -168.3 142.99 3.45 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -174.55 60.93 0.12 Allowed Glycine 0 C--O 1.218 -0.847 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.08 -68.85 0.05 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.475 0.655 . . . . 0.0 110.985 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -73.09 173.1 9.86 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 122.063 -0.398 . . . . 0.0 110.512 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.4 100.98 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.997 0.903 . . . . 0.0 110.334 178.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.25 -149.41 5.23 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 109.064 -1.615 . . . . 0.0 109.064 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.7 -54.21 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.38 -147.38 0.09 Allowed 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.4 m -62.12 -155.08 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.042 1.737 . . . . 0.0 111.992 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -72.66 -36.26 67.9 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 118.955 -2.341 . . . . 0.0 111.968 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -177.93 37.59 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 125.272 1.429 . . . . 0.0 109.298 -178.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.536 ' SG ' HG22 ' A' ' 22' ' ' VAL . 53.3 t -81.8 -52.26 7.3 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 178.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.442 ' CG ' ' H ' ' A' ' 20' ' ' GLN . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.582 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.582 ' N ' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.536 HG22 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.564 ' OD2' ' HB3' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.917 HD23 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.441 ' SG ' HD11 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.624 ' OE1' HD13 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.624 HD13 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.17 -42.79 0.18 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 99.7 p -144.01 116.01 8.35 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.9 t -150.92 127.31 10.67 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -168.1 62.07 0.07 Allowed 'General case' 0 C--O 1.234 0.252 0 O-C-N 123.715 0.635 . . . . 0.0 109.838 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -43.04 141.57 1.13 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 123.349 1.547 . . . . 0.0 111.599 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 89.3 p -86.73 98.9 11.4 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 120.396 -1.44 . . . . 0.0 109.475 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 m -139.79 138.02 35.5 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 120.932 -1.105 . . . . 0.0 108.875 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.71 -0.78 51.32 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.818 -0.435 . . . . 0.0 112.868 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -146.55 64.32 1.2 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.211 1.404 . . . . 0.0 109.795 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.55 -155.25 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 123.33 1.538 . . . . 0.0 110.823 176.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.561 HG23 ' HA ' ' A' ' 65' ' ' GLN . 1.2 p -85.14 22.33 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 O-C-N 120.999 -1.063 . . . . 0.0 112.399 174.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.83 46.15 1.31 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.124 -0.985 . . . . 0.0 109.884 178.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -130.58 172.93 11.39 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 121.458 -0.776 . . . . 0.0 111.047 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -165.83 78.14 1.21 Allowed Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.12 -16.28 25.39 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 120.958 1.105 . . . . 0.0 112.425 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 139.8 102.1 0.51 Allowed Glycine 0 C--O 1.222 -0.625 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 173.15 114.21 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.97 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.817 1.323 . . . . 0.0 111.926 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -116.59 -167.26 1.26 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -176.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -38.51 152.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 122.578 1.18 . . . . 0.0 113.872 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.2 -32.86 14.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.479 -0.889 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -165.92 -84.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.424 0.69 . . . . 0.0 110.577 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -88.32 86.1 7.0 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 121.375 -0.828 . . . . 0.0 110.806 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.65 52.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.938 0.875 . . . . 0.0 112.134 -174.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.17 -28.47 69.68 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.118 HD13 ' HG ' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.542 ' HG2' HG21 ' A' ' 47' ' ' VAL . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' HG23 ' A' ' 47' ' ' VAL . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.798 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.798 HG22 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.667 HG13 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.568 ' H ' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.484 ' OD2' ' N ' ' A' ' 1' ' ' ALA . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.544 ' O ' ' HB1' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.667 ' HG3' HG13 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.564 ' HB3' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.534 ' N ' HD22 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.45 HD11 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.901 ' CB ' ' HE3' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.674 ' HA ' HD11 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD22 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.674 HD11 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.463 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.802 ' HG ' HG23 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.581 ' OG ' HG23 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.412 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.802 HG23 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.592 ' CG ' HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.656 ' O ' HG22 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.419 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.788 ' CD1' HD11 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.675 HG12 ' HA ' ' A' ' 116' ' ' VAL . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 1.118 ' HG ' HD13 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.599 ' O ' HG23 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.441 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.77 HG22 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.917 ' HG3' HD23 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.901 ' HE3' ' CB ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.77 ' HB3' HG22 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p -71.64 139.84 49.45 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.83 174.64 0.66 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.508 0.723 . . . . 0.0 110.18 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.3 p -149.68 113.4 5.05 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.7 m120 . . . . . 0 C--O 1.253 1.279 0 O-C-N 121.629 -0.669 . . . . 0.0 109.446 177.25 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.39 170.44 10.54 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 123.757 0.661 . . . . 0.0 111.175 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -57.73 133.89 55.76 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.813 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 ttt -152.86 147.88 26.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 173.58 2.28 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 124.011 0.819 . . . . 0.0 110.363 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.6 t -49.36 174.42 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.678 1.227 . . . . 0.0 110.701 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.47 109.07 0.13 Allowed 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 120.848 -1.157 . . . . 0.0 110.302 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.76 55.09 0.23 Allowed Glycine 0 C--O 1.22 -0.767 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.36 -40.48 0.06 Allowed 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 121.678 0.751 . . . . 0.0 110.82 178.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -161.62 -43.98 0.04 OUTLIER 'General case' 0 C--O 1.213 -0.851 0 O-C-N 121.357 -0.839 . . . . 0.0 110.475 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.38 147.1 46.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.211 0.319 . . . . 0.0 110.41 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.75 -161.75 20.11 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -81.37 48.94 1.21 Allowed 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.503 0.668 . . . . 0.0 110.748 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.736 ' HG ' ' NH1' ' A' ' 19' ' ' ARG . 23.8 p -166.59 114.15 0.86 Allowed 'General case' 0 C--O 1.215 -0.711 0 CA-C-O 122.012 0.91 . . . . 0.0 110.17 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -155.17 -40.69 0.09 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 116.722 -1.608 . . . . 0.0 110.422 179.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -44.33 -84.79 0.0 OUTLIER 'General case' 0 C--N 1.345 0.388 0 O-C-N 125.803 1.939 . . . . 0.0 110.33 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -157.09 20.4 0.31 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.435 0.636 . . . . 0.0 109.939 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.546 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -80.14 -48.34 13.34 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 -179.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.736 ' NH1' ' HG ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.596 HG13 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.469 ' HB2' HG12 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.828 HD23 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.535 ' SG ' HD11 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.636 ' HG2' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.469 ' H ' HD13 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.409 ' HB2' HE22 ' A' ' 89' ' ' GLN . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.81 -45.22 11.79 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.3 p -172.21 120.78 0.43 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.669 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -32.63 125.71 0.32 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 122.553 1.168 . . . . 0.0 112.247 174.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.56 -61.4 0.02 OUTLIER 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.125 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.28 116.58 1.45 Allowed 'General case' 0 C--N 1.345 0.386 0 O-C-N 123.655 0.597 . . . . 0.0 109.711 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.5 p -170.34 -151.39 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 124.479 1.112 . . . . 0.0 110.038 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 m -82.33 143.14 31.47 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.696 0.799 . . . . 0.0 110.623 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.87 -115.41 0.06 OUTLIER Glycine 0 C--N 1.333 0.388 0 CA-C-O 122.019 0.788 . . . . 0.0 111.412 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.25 -10.15 39.36 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.147 -0.62 . . . . 0.0 110.169 178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -101.06 54.13 0.84 Allowed 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 123.316 1.531 . . . . 0.0 109.973 178.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -139.63 29.68 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 O-C-N 118.583 -2.573 . . . . 0.0 108.868 -179.451 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.1 35.97 4.59 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 120.481 -1.387 . . . . 0.0 109.328 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.06 29.37 6.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.829 -0.544 . . . . 0.0 111.721 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.457 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER 168.28 -53.73 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.644 0.778 . . . . 0.0 111.021 -175.643 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.457 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 17.7 Cg_endo -75.34 86.62 1.43 Allowed 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.515 2.144 . . . . 0.0 111.264 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.72 -90.97 0.08 OUTLIER Glycine 0 C--O 1.218 -0.891 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -76.37 -69.5 0.5 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.18 -179.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.097 0.873 . . . . 0.0 110.04 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 59.14 165.11 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 122.794 1.283 . . . . 0.0 110.343 -178.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -43.11 127.36 4.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 111.238 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.47 86.36 1.0 Allowed 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.494 1.121 . . . . 0.0 109.746 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.76 -57.69 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -158.37 50.4 0.4 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 123.112 1.434 . . . . 0.0 110.156 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.2 p -168.55 53.66 0.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.323 -1.486 . . . . 0.0 108.942 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -63.56 -18.47 63.9 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.975 HD13 HD11 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.885 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.885 HG22 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.419 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.491 HG13 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.596 ' OE2' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.738 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.76 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.486 HG21 ' O ' ' A' ' 81' ' ' ALA . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.76 ' HB2' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.572 ' O ' HD22 ' A' ' 95' ' ' LEU . 5.6 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.744 HD11 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . 0.575 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.5 ' C ' HD21 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.676 HD22 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . 0.575 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.476 HG23 ' HG ' ' A' ' 95' ' ' LEU . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.702 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.975 HD11 HD13 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.857 HG23 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.762 ' HG ' ' CD2' ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.567 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.6 ' O ' HG12 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.753 HG12 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.828 ' HG2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.857 ' CB ' HG23 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.753 ' CG ' HG12 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' THR . . . . . 0.665 HG21 ' H ' ' A' ' 123' ' ' ARG . 4.3 m -94.46 -159.81 0.73 Allowed 'General case' 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.665 ' H ' HG21 ' A' ' 122' ' ' THR . 0.0 OUTLIER -43.37 -82.77 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.945 -1.097 . . . . 0.0 111.758 -178.862 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.0 p -47.24 162.16 0.06 Allowed 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.195 2.185 . . . . 0.0 110.664 178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.7 t30 . . . . . 0 CA--C 1.57 1.728 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.905 178.869 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.826 HD13 HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.401 ' SG ' HD12 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.848 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.472 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.496 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.826 HG22 HD13 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.456 HG23 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.519 HD12 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.848 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.498 HG23 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.517 HD11 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.517 ' CG2' HD11 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.707 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.77 HG21 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.76 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.432 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.77 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.696 HG12 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.66 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.989 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 . . . . . 0 C--O 1.216 -0.659 0 CA-C-O 120.76 0.314 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.799 HD23 ' OG ' ' A' ' 113' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.811 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.611 ' O ' HD23 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.58 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.696 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.764 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.621 ' OE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.764 HD12 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.471 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.691 HD12 HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.691 HG21 HD12 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.547 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.579 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.74 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.799 ' OG ' HD23 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.475 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.989 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.714 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.806 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.917 HG13 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.409 ' HG2' ' CZ ' ' A' ' 84' ' ' TYR . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.917 ' HB2' HG13 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.514 ' SG ' HD13 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' HD21 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.55 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.749 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.827 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.827 HG23 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 HD12 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.418 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.629 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.572 ' HA ' HD23 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.493 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.723 HD12 HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.723 HG21 HD12 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.739 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.749 HG23 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.771 HG11 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.544 ' CB ' HD21 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.698 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.696 ' NE ' HG11 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.771 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.627 ' HB3' HG23 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.562 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG22 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.893 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.764 ' HB3' HG21 ' A' ' 85' ' ' ILE . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' HD12 ' A' ' 27' ' ' LEU . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.731 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.566 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.742 HG22 HD13 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.893 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.48 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.559 ' HA ' HG22 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.764 HG21 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.679 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.45 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.884 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.731 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.566 HD12 HD21 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.673 HG21 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.809 HG22 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.704 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.673 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.624 ' HB3' HG23 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.809 ' HB2' HG22 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.521 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.73 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.76 HD22 ' H ' ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.877 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.488 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.832 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 . . . . . 0 C--O 1.224 -0.275 0 CA-C-O 122.578 1.18 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.055 HD11 HD12 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.786 ' O ' HG23 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.521 ' HB3' HG21 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.41 ' CG ' ' HG3' ' A' ' 117' ' ' ARG . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.409 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.73 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.511 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.877 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.571 ' HA ' HD23 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.441 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.641 ' CD1' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.443 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.832 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 1.055 HD12 HD11 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.8 HG21 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD23 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.572 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.617 HG13 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.603 ' HD3' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.409 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.8 ' HB3' HG21 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.617 ' HG2' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p . . . . . 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.465 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.492 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.515 ' CG1' ' CD2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.492 ' CE ' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.869 HD21 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.433 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.557 ' HB2' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.509 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.674 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 CA--C 1.538 0.507 0 CA-C-O 121.54 0.686 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.509 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.742 HD11 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.676 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.84 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.564 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.619 HD13 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.515 ' CD2' ' CG1' ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD23 ' A' ' 95' ' ' LEU . 8.0 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.598 ' CG1' HG11 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.497 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.868 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.403 HH21 ' CD1' ' A' ' 95' ' ' LEU . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.868 HG21 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.497 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.742 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.688 HG21 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.587 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.657 HG23 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.869 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.688 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.657 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.836 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.651 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.462 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.472 ' O ' HG23 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.881 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.799 HG11 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.799 ' HG3' HG11 ' A' ' 73' ' ' VAL . 10.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.81 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.439 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 85' ' ' ILE . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 90' ' ' ILE . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.477 ' CD1' HG11 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.62 ' HA ' HD12 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.566 ' CG2' HD11 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.651 ' CB ' HD13 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.549 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.533 HD12 HD21 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.751 HG21 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.47 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.612 ' HA ' HG13 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.881 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.751 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.501 ' H ' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.708 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.775 HD11 HD12 ' A' ' 110' ' ' ILE . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.582 HG11 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.708 HG23 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.551 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.545 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.615 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.57 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.408 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.452 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.61 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.412 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.782 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.782 HG21 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.58 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.775 HD12 HD11 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.629 HG21 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.596 ' OG ' HD23 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.482 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.582 ' NE ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.452 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.629 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.532 ' HD3' HG13 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.615 HG22 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p . . . . . 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.927 HD13 HG22 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.425 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.438 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.636 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 110' ' ' ILE . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.717 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.425 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.927 HG22 HD13 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.879 HG11 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.879 ' HB3' HG11 ' A' ' 73' ' ' VAL . 1.1 pt20 -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.704 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.445 ' CD2' ' O ' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.414 ' HB1' ' CE ' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.924 ' HA ' HD12 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB2' ' C ' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD23 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.924 HD12 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.519 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.942 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.521 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.942 HG21 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.707 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.771 HG13 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.585 ' CB ' HD23 ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.504 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.771 ' HA ' HG13 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.669 ' HD2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.746 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.619 ' HB3' HG23 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.664 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.3 OUTLIER -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.437 ' SG ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.736 HG22 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.736 ' OD2' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.876 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.577 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.365 0.126 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.536 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.084 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.647 ' SG ' HG22 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 1.021 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.429 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.638 HG23 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.435 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.567 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.876 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.593 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.46 ' HA ' ' CE ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' C ' HD12 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.5 ' N ' HD12 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.53 ' O ' HD23 ' A' ' 95' ' ' LEU . 16.4 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.612 HD12 ' C ' ' A' ' 86' ' ' ALA . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' A' ' 96' ' ' HIS . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.533 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.784 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.413 ' NE2' ' HA ' ' A' ' 91' ' ' GLN . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.784 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.763 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 1.084 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.802 HG21 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.538 ' HB3' HD23 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.521 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.565 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 1.021 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.802 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' THR . . . . . 0.744 HG23 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m . . . . . 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.558 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.9 t . . . . . 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.532 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.502 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CE ' ' O ' ' A' ' 72' ' ' GLN . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CD1' HG22 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HA ' HG21 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.634 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.776 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.425 ' HB2' ' NE2' ' A' ' 89' ' ' GLN . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.909 HD11 HD12 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.788 HG22 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.489 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.418 ' N ' ' CG1' ' A' ' 73' ' ' VAL . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.461 ' CB ' HG11 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.829 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.532 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.829 HG22 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.425 ' NE2' ' HB2' ' A' ' 35' ' ' ARG . 16.8 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' HD23 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.47 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.877 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.877 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.776 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.634 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.909 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.695 HG11 ' HB3' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.794 ' HB2' HD23 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.695 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.448 ' HB3' HG23 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.684 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.501 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.684 ' CB ' HG22 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.622 HD21 ' HD3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.461 ' SG ' HD12 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.609 ' OE1' HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.45 ' CD2' HD11 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.76 HD13 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.237 0.065 . . . . 0.0 111.074 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.729 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.836 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.456 ' HG2' ' NH1' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.611 ' HB3' HD22 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.536 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.512 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.628 HD22 ' N ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.736 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.729 HG23 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.581 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.622 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.872 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.538 ' CD ' HG12 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.654 HG22 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.654 ' CG ' HG22 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HB3' HG21 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' HD11 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD11 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 . . . . . 0 C--O 1.202 -1.396 0 CA-C-O 121.139 0.495 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' O ' HG23 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.806 HG22 HD13 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.434 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.452 ' HD2' HG22 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.53 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.585 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.734 HG13 HG11 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.494 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.796 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.796 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.747 HD12 HD11 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.813 HG21 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.477 ' CB ' HD23 ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.727 HG23 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.727 ' HB3' HG23 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.567 ' HB2' HG22 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.1 p . . . . . 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.494 ' HB3' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.42 ' NH1' ' HB2' ' A' ' 84' ' ' TYR . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.563 HG12 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.69 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.825 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.694 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 . . . . . 0 CA--C 1.533 0.319 0 CA-C-O 120.986 0.422 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.9 mm100 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.643 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 10.7 mm-40 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.778 HG22 HD13 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.487 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.563 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.825 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.525 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.464 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.624 ' HA ' HD23 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.801 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 103' ' ' VAL . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.801 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.694 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.609 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.77 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.635 HG21 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.737 ' CB ' HD23 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.513 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.63 ' HA ' HG13 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' CYS . . . . . 0.487 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.635 ' HB3' HG21 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HD2' HG22 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' HG13 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.603 HD13 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.469 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD13 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? . . . . . 0 C--O 1.214 -0.802 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.072 HD11 HD12 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.525 HG22 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.525 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.476 ' HB3' HG21 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.669 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.458 ' HA ' HD13 ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.497 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.669 HG22 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.568 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.455 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.586 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.653 HG13 HG11 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.416 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.758 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.758 HG21 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.664 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.664 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.413 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 1.072 HD12 HD11 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.777 HG21 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.722 ' HB2' HD23 ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.427 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.618 ' HA ' HG13 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.441 ' HE ' ' N ' ' A' ' 116' ' ' VAL . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.777 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.563 ' CG ' HG13 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.442 ' C ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.418 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.814 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' HD12 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.569 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.601 HD13 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.487 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.94 HD11 HD12 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.848 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.814 HG23 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.662 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.614 ' HG3' HG11 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.669 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.703 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.436 HG21 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 95' ' ' LEU . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.476 ' OE2' HD13 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.601 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.639 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.94 HD12 HD11 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.737 HG13 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.491 ' O ' HG21 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.479 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.905 HG23 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.589 ' HD3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.702 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.905 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.684 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.453 ' HG2' ' N ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.453 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 2.6 tt0 -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.686 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.506 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HZ1' ' NE ' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.671 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.876 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.598 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.501 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 121.28 0.562 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.501 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.896 HD11 HD12 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.622 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.851 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.534 ' NE ' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.686 ' HB3' HG21 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 15.2 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.568 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.516 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.537 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.607 ' O ' HD23 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.662 HG13 HG11 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.49 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.711 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.711 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.711 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.734 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.896 HD12 HD11 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.511 ' CB ' HD23 ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.653 HG13 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.851 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.707 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.653 ' HD3' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.849 HD13 HG22 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.747 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 C--O 1.223 -0.321 0 CA-C-O 120.751 0.31 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.091 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.709 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.849 HG22 HD13 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.426 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.645 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.402 ' N ' HG13 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.645 ' HG3' HG11 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.826 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.51 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.826 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.591 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.452 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.896 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.426 ' HB2' HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.896 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.747 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.583 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 1.091 HD12 HD11 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.423 ' O ' HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.543 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.569 HG13 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.528 ' HD2' HG13 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.714 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.569 ' HB3' HG13 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 116' ' ' VAL . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 22' ' ' VAL . 53.3 t . . . . . 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' CD ' ' HG2' ' A' ' 74' ' ' ARG . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.528 HG23 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.924 HD21 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.43 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.614 ' OE1' HD11 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.512 ' CD2' HD11 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.787 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.689 HG11 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.524 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.689 ' HG3' HG11 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.556 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.526 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.675 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.57 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.675 HD12 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.455 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.575 ' OG ' HG21 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.44 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.803 HG21 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.581 ' CG ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.646 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.777 ' CD1' HD12 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 119' ' ' MET . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.868 ' HB3' HD21 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.591 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.771 HG23 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.924 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.671 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.771 ' HB3' HG23 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.537 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.486 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' SG ' HD12 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.647 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.475 ' H ' HD11 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.954 HD11 HD12 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.875 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.448 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.495 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.72 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.751 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 ' H ' ' A' ' 32' ' ' ARG . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.567 ' O ' HD23 ' A' ' 95' ' ' LEU . 16.7 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.735 HD12 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.653 HD23 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 96' ' ' HIS . . . . . 0.594 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.486 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.716 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.647 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.954 HD12 HD11 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.848 HG21 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.434 ' OG ' HD23 ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.558 ' O ' HG21 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.592 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.745 HG13 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.81 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.848 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.745 ' CG ' HG13 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 121' ' ' GLN . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -154.07 166.6 32.52 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.529 0.732 . . . . 0.0 110.128 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -172.76 101.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.151 0.907 . . . . 0.0 110.045 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.48 149.19 23.75 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 121.958 -0.464 . . . . 0.0 109.805 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -170.82 167.57 7.52 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.88 136.81 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.103 0.961 . . . . 0.0 109.653 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -141.81 161.54 37.71 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.442 0.697 . . . . 0.0 110.196 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.94 108.14 0.52 Allowed Glycine 0 C--O 1.222 -0.615 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -144.45 142.33 30.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 177.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.62 167.45 30.1 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 146.89 31.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.483 0.659 . . . . 0.0 110.271 175.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.74 172.35 30.45 Favored Glycine 0 C--O 1.223 -0.588 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 m -116.71 -83.55 0.63 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 119.242 -0.409 . . . . 0.0 111.479 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 63.5 p -63.73 -157.56 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 t -59.78 -153.59 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 173.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -39.19 -63.88 0.51 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.272 -0.892 . . . . 0.0 112.78 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -161.65 48.93 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 122.405 1.097 . . . . 0.0 109.861 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m -76.44 -62.72 1.53 Allowed 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.826 HD13 HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.401 ' SG ' HD12 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.848 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.472 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -44.91 12.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -171.25 143.4 1.87 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.24 150.93 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.424 1.09 . . . . 0.0 111.638 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.39 175.38 13.94 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.756 -0.59 . . . . 0.0 109.729 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -53.92 159.16 1.81 Allowed 'General case' 0 C--N 1.333 -0.149 0 O-C-N 123.645 0.591 . . . . 0.0 111.014 176.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.27 -156.21 0.32 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.1 p -82.1 129.44 34.81 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.961 1.304 . . . . 0.0 111.407 176.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 138.24 118.91 1.7 Allowed Glycine 0 C--O 1.226 -0.388 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.46 1.84 13.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 174.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -96.11 61.52 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 120.7 -1.25 . . . . 0.0 111.326 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 47' ' ' VAL . 69.6 t -150.89 59.31 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 123.571 1.653 . . . . 0.0 108.394 -177.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.504 HD23 ' N ' ' A' ' 48' ' ' LEU . 1.7 pt? -132.11 38.57 3.49 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 120.511 -1.368 . . . . 0.0 109.418 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.58 132.91 26.6 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.9 mtm -73.01 -53.88 4.78 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 124.59 1.182 . . . . 0.0 112.961 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -72.92 -18.45 24.41 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.406 2.071 . . . . 0.0 111.609 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.47 108.34 0.16 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.14 -63.83 1.16 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.443 0.64 . . . . 0.0 110.561 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.74 74.28 5.79 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.766 0.793 . . . . 0.0 109.733 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -179.31 156.89 0.77 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.931 0.892 . . . . 0.0 108.898 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.35 119.87 1.13 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.339 0.655 . . . . 0.0 111.683 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.24 92.28 0.08 Allowed 'General case' 0 CA--C 1.515 -0.401 0 O-C-N 124.134 0.896 . . . . 0.0 109.363 -174.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 177.11 138.88 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -48.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 123.107 1.432 . . . . 0.0 111.902 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.8 p -168.48 56.92 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.971 1.367 . . . . 0.0 108.96 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -61.08 -14.14 21.9 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.496 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.8 mm-40 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.826 HG22 HD13 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.456 HG23 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.519 HD12 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.848 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.498 HG23 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.517 HD11 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.517 ' CG2' HD11 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.707 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.77 HG21 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.76 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.432 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.77 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.478 ' O ' HG23 ' A' ' 124' ' ' THR . 19.5 p -142.65 -177.91 5.53 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.19 136.37 30.31 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.781 0.719 . . . . 0.0 111.882 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.478 HG23 ' O ' ' A' ' 122' ' ' THR . 26.0 p -136.18 -47.14 0.64 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-O 115.37 -2.253 . . . . 0.0 108.231 -174.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 112.195 -3.764 . . . . 0.0 110.488 -173.32 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -166.3 152.0 8.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -177.25 162.06 1.9 Allowed 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 124.25 0.969 . . . . 0.0 110.298 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.5 ttt 171.51 131.26 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 O-C-N 124.917 1.386 . . . . 0.0 110.462 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.14 166.95 28.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 118.528 -0.748 . . . . 0.0 109.314 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.5 p 167.6 160.02 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 125.695 1.872 . . . . 0.0 108.768 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.65 158.35 0.13 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.703 1.201 . . . . 0.0 110.3 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.45 102.86 1.38 Allowed Glycine 0 C--O 1.228 -0.244 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -165.98 149.32 7.6 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.507 -0.407 . . . . 0.0 110.363 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.98 169.33 23.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 116.607 -1.663 . . . . 0.0 109.902 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.36 -162.53 1.57 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.257 0.973 . . . . 0.0 111.308 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.11 72.01 0.81 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.44 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.504 0.668 . . . . 0.0 110.557 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 p -59.49 151.7 23.51 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.407 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -174.85 0.06 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.689 178.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -57.11 -42.05 80.1 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.385 -0.822 . . . . 0.0 110.77 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -175.86 40.37 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.67 -25.91 49.9 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 179.029 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG12 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HZ2' ' HB3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.66 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.989 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.75 -150.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -113.76 51.51 0.86 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.83 0.852 . . . . 0.0 111.03 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.5 p -154.16 151.24 29.0 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.528 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 ttm105 -89.6 81.04 6.54 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.71 -0.619 . . . . 0.0 110.507 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -57.95 132.72 54.26 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 116.384 -1.769 . . . . 0.0 109.325 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.8 m -169.67 136.23 1.59 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 126.069 2.106 . . . . 0.0 108.606 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.8 m -91.96 5.92 48.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.651 0.738 . . . . 0.0 111.468 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.22 -120.26 0.98 Allowed Glycine 0 N--CA 1.447 -0.573 0 O-C-N 121.234 -0.916 . . . . 0.0 111.345 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -163.37 -49.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 109.78 7.66 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 122.421 1.105 . . . . 0.0 108.983 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.405 ' O ' HG13 ' A' ' 47' ' ' VAL . 1.3 p -87.64 24.16 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 122.379 1.085 . . . . 0.0 111.091 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.8 mt -105.22 59.18 0.68 Allowed 'General case' 0 C--N 1.326 -0.425 0 O-C-N 120.324 -1.485 . . . . 0.0 108.31 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.36 23.95 13.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 O-C-N 121.422 -0.799 . . . . 0.0 111.81 176.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -143.0 161.35 49.01 Favored Pre-proline 0 N--CA 1.443 -0.783 0 C-N-CA 122.319 0.248 . . . . 0.0 111.548 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.98 68.79 6.45 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.742 2.294 . . . . 0.0 110.202 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -101.82 21.19 43.07 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 114.507 -3.385 . . . . 0.0 110.249 177.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.89 -43.73 66.38 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.3 2.05 . . . . 0.0 110.207 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.53 65.97 7.91 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 122.563 1.173 . . . . 0.0 110.158 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -119.37 152.33 36.98 Favored 'General case' 0 N--CA 1.441 -0.889 0 O-C-N 120.967 -1.083 . . . . 0.0 109.256 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -48.76 131.57 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.88 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -134.83 117.28 15.74 Favored 'General case' 0 CA--C 1.504 -0.81 0 O-C-N 124.214 0.946 . . . . 0.0 109.549 -177.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 175.94 -73.51 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 O-C-N 124.366 1.041 . . . . 0.0 110.121 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -147.75 37.39 0.89 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 123.266 1.508 . . . . 0.0 109.185 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.87 ' CB ' HD22 ' A' ' 63' ' ' LEU . 4.0 p -173.05 67.49 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 123.276 1.513 . . . . 0.0 108.789 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -70.5 -27.53 64.27 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 119.99 -1.694 . . . . 0.0 110.342 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.87 HD22 ' CB ' ' A' ' 60' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.811 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.427 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.611 ' O ' HD23 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.58 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.696 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.764 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.621 ' OE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.764 HD12 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.471 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.691 HD12 HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.691 HG21 HD12 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.547 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.579 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.74 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.799 ' OG ' HD23 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.475 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.989 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.714 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.652 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -97.13 -165.56 1.28 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.652 ' H ' HG22 ' A' ' 122' ' ' THR . 3.0 mtm180 -83.95 89.08 7.17 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 115.46 -2.21 . . . . 0.0 108.209 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 42.0 p -39.54 -81.74 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 O-C-N 126.755 2.534 . . . . 0.0 115.049 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.427 ' OXT' ' HB3' ' A' ' 75' ' ' ASP . 1.7 m-20 . . . . . 0 C--O 1.241 0.651 0 O-C-N 126.228 2.205 . . . . 0.0 107.915 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -143.87 -82.51 0.17 Allowed 'General case' 0 C--O 1.234 0.282 0 O-C-N 123.682 0.614 . . . . 0.0 109.66 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -172.93 178.67 2.49 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -101.29 -172.51 2.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 123.821 0.701 . . . . 0.0 111.992 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.78 160.83 15.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.991 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.0 p 171.72 156.76 0.08 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.407 0.622 . . . . 0.0 109.792 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -169.11 165.96 11.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.1 103.51 0.93 Allowed Glycine 0 C--O 1.218 -0.888 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.72 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -166.16 -56.08 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.534 0.683 . . . . 0.0 110.369 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -159.87 161.42 34.41 Favored 'General case' 0 CA--C 1.514 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 110.96 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -87.37 -159.99 0.56 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 123.779 0.675 . . . . 0.0 110.676 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.74 -165.25 25.91 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.6 t -89.02 29.89 1.0 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.479 . . . . 0.0 110.91 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -172.18 2.48 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 121.868 -0.52 . . . . 0.0 110.006 -179.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -54.78 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 124.315 1.009 . . . . 0.0 110.869 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 15' ' ' SER . 2.6 tt0 -40.8 -57.59 1.89 Allowed 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.341 -0.849 . . . . 0.0 110.558 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -177.24 49.29 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.936 1.351 . . . . 0.0 109.936 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.806 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -78.18 -38.65 42.93 Favored 'General case' 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.917 HG13 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.409 ' HG2' ' CZ ' ' A' ' 84' ' ' TYR . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.917 ' HB2' HG13 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.514 ' SG ' HD13 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' HD21 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -84.02 -150.72 0.11 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -127.59 40.17 3.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.863 0.839 . . . . 0.0 110.351 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -166.02 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 122.132 0.968 . . . . 0.0 110.186 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -167.93 97.9 0.45 Allowed 'General case' 0 CA--C 1.506 -0.745 0 O-C-N 121.818 -0.551 . . . . 0.0 110.257 178.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.92 157.46 0.88 Allowed 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.469 0.48 . . . . 0.0 110.153 178.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.9 t -172.51 144.0 1.43 Allowed 'General case' 0 C--N 1.322 -0.589 0 O-C-N 123.922 0.764 . . . . 0.0 109.822 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -70.53 97.43 1.31 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.575 1.178 . . . . 0.0 109.819 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.32 -118.23 0.44 Allowed Glycine 0 C--O 1.225 -0.429 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -165.69 -54.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.977 0.457 . . . . 0.0 110.768 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.17 119.29 10.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.281 1.039 . . . . 0.0 109.236 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.34 53.2 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.548 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -172.93 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 124.17 1.938 . . . . 0.0 108.736 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.08 28.71 0.89 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 118.172 -2.83 . . . . 0.0 110.513 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -137.82 62.31 33.63 Favored Pre-proline 0 N--CA 1.446 -0.657 0 CA-C-O 121.397 0.618 . . . . 0.0 111.667 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -72.61 70.89 3.31 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.269 1.979 . . . . 0.0 112.141 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.8 -4.31 10.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-O 118.259 -1.301 . . . . 0.0 111.277 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 170.96 108.99 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 117.343 -1.313 . . . . 0.0 110.416 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -33.76 108.82 0.06 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.644 1.688 . . . . 0.0 112.122 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -110.81 33.6 4.48 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 120.312 -1.492 . . . . 0.0 109.039 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -106.37 164.38 12.08 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.141 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -123.07 -41.52 2.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.333 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.76 -54.6 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.349 0.406 . . . . 0.0 110.448 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.25 86.7 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 123.841 1.782 . . . . 0.0 110.321 -178.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.5 p -171.25 83.7 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 O-C-N 119.137 -2.227 . . . . 0.0 108.78 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -33.78 15.33 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.55 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.749 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.827 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.827 HG23 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 HD12 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.418 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.629 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.572 ' HA ' HD23 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.493 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.723 HD12 HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.723 HG21 HD12 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.739 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.749 HG23 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.771 HG11 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.544 ' CB ' HD21 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.698 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.696 ' NE ' HG11 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.771 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.627 ' HB3' HG23 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p -92.08 -169.24 2.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.621 ' C ' HG22 ' A' ' 124' ' ' THR . 0.0 OUTLIER -56.76 83.52 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.47 0 O-C-N 121.271 -0.893 . . . . 0.0 112.386 -179.332 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.621 HG22 ' C ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER 158.74 152.49 0.01 OUTLIER 'General case' 0 C--O 1.238 0.481 0 O-C-N 124.328 1.017 . . . . 0.0 112.176 -170.301 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.5 p30 . . . . . 0 CA--C 1.558 1.27 0 CA-C-O 116.266 -1.826 . . . . 0.0 111.821 175.026 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -157.4 167.66 29.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.878 -0.582 . . . . 0.0 109.572 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -159.78 112.09 2.09 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.361 1.038 . . . . 0.0 109.407 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -140.65 167.37 22.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.294 0.569 . . . . 0.0 110.376 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 167.24 15.71 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 171.32 133.66 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.858 0.863 . . . . 0.0 109.54 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -163.53 174.88 11.27 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.619 0.768 . . . . 0.0 109.942 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 173.33 96.59 0.1 Allowed Glycine 0 C--O 1.221 -0.664 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.8 144.68 32.68 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 177.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.52 166.66 31.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.393 0.677 . . . . 0.0 110.231 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -141.67 156.88 45.62 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.616 0.572 . . . . 0.0 109.835 175.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.91 150.34 3.83 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-O 122.64 1.133 . . . . 0.0 112.562 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.91 78.95 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -177.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -59.42 171.25 0.84 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.651 174.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -176.01 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.334 175.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -40.77 -62.69 0.76 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.175 0.988 . . . . 0.0 112.893 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -161.37 37.39 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 123.222 1.487 . . . . 0.0 109.672 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.562 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.93 -42.8 69.37 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 177.188 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG22 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.893 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.764 ' HB3' HG21 ' A' ' 85' ' ' ILE . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' HD12 ' A' ' 27' ' ' LEU . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.731 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.54 -47.52 9.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -162.77 100.81 1.01 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 m -37.89 155.78 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 123.332 1.539 . . . . 0.0 114.525 169.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -168.89 78.31 0.12 Allowed 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 118.965 -2.335 . . . . 0.0 108.2 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.627 ' HD3' HG21 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -43.85 132.12 5.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 t -78.01 -152.91 0.06 Allowed 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.021 1.451 . . . . 0.0 108.144 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 p -138.45 94.23 2.83 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 125.51 1.524 . . . . 0.0 109.171 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -146.01 12.2 1.66 Allowed Glycine 0 C--O 1.216 -0.999 0 CA-C-O 118.078 -1.401 . . . . 0.0 112.719 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -142.75 -85.09 0.16 Allowed 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 118.318 1.059 . . . . 0.0 110.298 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -141.04 27.23 1.98 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 123.85 1.786 . . . . 0.0 110.414 -177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.627 HG21 ' HD3' ' A' ' 41' ' ' ARG . 36.6 t -88.77 17.13 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.491 -1.381 . . . . 0.0 109.801 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.604 ' O ' HD12 ' A' ' 48' ' ' LEU . 1.8 pp -100.5 34.09 2.51 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 120.535 -1.353 . . . . 0.0 109.735 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -39.71 151.45 0.04 OUTLIER 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 123.349 0.659 . . . . 0.0 109.529 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -38.39 -53.97 2.93 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 175.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -70.33 -36.87 8.59 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 122.46 2.107 . . . . 0.0 113.033 174.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.27 -56.2 3.24 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 126.416 1.96 . . . . 0.0 110.569 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.56 -68.37 0.18 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.588 1.955 . . . . 0.0 109.89 177.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.49 167.74 10.18 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 123.123 1.439 . . . . 0.0 112.052 175.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -131.88 -157.98 0.86 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.222 176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.66 114.06 0.24 Allowed 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 111.35 174.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -46.52 140.41 4.34 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 124.323 1.015 . . . . 0.0 110.944 -174.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 177.79 131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -176.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -72.67 55.44 0.37 Allowed 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 122.536 1.16 . . . . 0.0 112.127 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.425 ' HB3' ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER 172.55 79.89 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.59 1.156 . . . . 0.0 109.278 -177.068 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -56.62 -31.38 64.26 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.566 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.742 HG22 HD13 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.893 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.48 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.559 ' HA ' HG22 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.764 HG21 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.679 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.45 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.884 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.731 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.566 HD12 HD21 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.673 HG21 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.809 HG22 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.704 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.673 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.624 ' HB3' HG23 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.809 ' HB2' HG22 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p -142.26 178.51 7.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -45.43 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.775 1.23 . . . . 0.0 112.349 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -89.49 106.86 18.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 124.912 1.382 . . . . 0.0 108.465 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.253 1.281 0 O-C-N 124.448 1.092 . . . . 0.0 111.428 -179.341 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.01 110.91 0.72 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.973 0.892 . . . . 0.0 110.873 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.505 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 53.1 p90 -71.81 157.09 38.51 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.72 -1.238 . . . . 0.0 111.439 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.65 106.21 0.23 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.178 0.513 . . . . 0.0 111.098 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.505 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 7.5 pt-20 -152.49 168.78 24.41 Favored 'General case' 0 CA--C 1.492 -1.275 0 CA-C-O 116.8 -1.571 . . . . 0.0 109.206 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 172.51 37.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 125.324 1.64 . . . . 0.0 109.303 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.25 165.11 24.29 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 119.929 -1.732 . . . . 0.0 111.445 177.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -159.42 -106.97 0.23 Allowed Glycine 0 C--O 1.225 -0.445 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -157.33 158.84 36.76 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -158.32 161.8 37.67 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.536 0.334 . . . . 0.0 110.266 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -82.7 -163.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.419 1.074 . . . . 0.0 111.424 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -41.67 163.32 0.02 OUTLIER Glycine 0 CA--C 1.538 1.503 0 CA-C-O 124.401 2.112 . . . . 0.0 113.161 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.8 m -119.89 -133.85 0.31 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 120.693 -1.475 . . . . 0.0 109.0 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.4 p -168.4 -170.39 1.25 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 124.401 1.08 . . . . 0.0 111.538 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.454 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.9 OUTLIER -70.07 154.0 42.48 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 -176.467 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -60.68 -16.77 42.72 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.188 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -175.05 83.22 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 122.567 1.175 . . . . 0.0 110.34 178.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.454 ' HB2' ' CB ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -158.92 -47.13 0.06 Allowed 'General case' 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 178.757 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.521 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.73 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.76 HD22 ' H ' ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.877 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.488 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.832 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.15 -63.59 1.28 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.7 t -154.86 83.87 1.09 Allowed 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -39.86 157.17 0.02 OUTLIER 'General case' 0 C--N 1.35 0.616 0 CA-C-O 123.68 1.705 . . . . 0.0 110.89 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.77 125.48 1.19 Allowed 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 118.663 -2.523 . . . . 0.0 108.082 176.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -43.88 133.48 4.87 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 125.324 1.64 . . . . 0.0 110.011 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.5 p -70.32 -153.57 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.279 1.514 . . . . 0.0 110.41 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -63.75 141.46 58.76 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.023 -1.048 . . . . 0.0 112.362 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 136.01 121.42 2.08 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.51 0.63 11.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.441 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.87 55.16 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 124.686 2.184 . . . . 0.0 112.554 177.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.67 ' O ' HD23 ' A' ' 48' ' ' LEU . 41.1 t -147.69 52.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 116.907 -3.62 . . . . 0.0 108.504 -173.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.67 HD23 ' O ' ' A' ' 47' ' ' VAL . 1.0 OUTLIER -143.95 51.08 1.32 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -175.919 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.412 ' CG ' ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -36.79 130.56 0.76 Allowed 'General case' 0 C--N 1.349 0.554 0 C-N-CA 123.144 0.577 . . . . 0.0 109.603 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -49.87 -53.6 40.9 Favored Pre-proline 0 C--N 1.327 -0.411 0 O-C-N 124.513 1.133 . . . . 0.0 112.241 176.365 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 49' ' ' ARG . 19.7 Cg_endo -74.36 -43.34 0.52 Allowed 'Trans proline' 0 N--CA 1.441 -1.59 0 CA-C-O 113.937 -2.609 . . . . 0.0 111.332 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 37.25 82.52 0.01 OUTLIER Glycine 0 C--N 1.343 0.936 0 O-C-N 127.229 2.83 . . . . 0.0 111.875 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.39 -60.37 0.03 OUTLIER 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.158 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -73.02 55.38 0.41 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.694 1.197 . . . . 0.0 110.833 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.44 ' HB3' ' CG ' ' A' ' 64' ' ' GLN . 5.4 m-80 -161.39 116.58 2.07 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 125.773 1.629 . . . . 0.0 108.37 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -42.1 104.33 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 124.774 1.296 . . . . 0.0 111.283 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.09 91.87 2.87 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 124.158 0.911 . . . . 0.0 108.654 -174.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 178.86 -72.97 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.944 0.778 . . . . 0.0 110.538 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -122.25 20.42 10.55 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 122.446 1.117 . . . . 0.0 109.97 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.61 43.47 0.09 Allowed 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 120.291 -1.506 . . . . 0.0 107.286 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -54.22 -19.5 5.31 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.4 -1.437 . . . . 0.0 111.683 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.055 HD11 HD12 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 55' ' ' ASN . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.786 ' O ' HG23 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.521 ' HB3' HG21 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.432 ' CD ' ' O ' ' A' ' 123' ' ' ARG . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.409 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.73 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.511 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.877 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.571 ' HA ' HD23 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.441 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.641 ' CD1' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.443 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.832 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 1.055 HD12 HD11 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.8 HG21 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD23 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.572 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.617 HG13 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.603 ' HD3' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.409 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.8 ' HB3' HG21 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.617 ' HG2' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HB3' ' C ' ' A' ' 125' ' ' ASN . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p -90.08 -167.08 1.74 Allowed 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.432 ' O ' ' CD ' ' A' ' 78' ' ' GLN . 6.1 mtm180 -39.47 -90.18 0.0 OUTLIER 'General case' 0 C--O 1.196 -1.731 0 CA-C-O 116.64 -1.648 . . . . 0.0 111.199 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -65.15 82.91 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 125.17 1.388 . . . . 0.0 111.118 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.407 ' C ' ' HB3' ' A' ' 121' ' ' GLN . 4.8 m-20 . . . . . 0 CA--C 1.562 1.411 0 CA-C-O 115.515 -2.184 . . . . 0.0 112.595 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.759 0 CA-C-O 117.425 -1.274 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.68 -57.2 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 125.129 1.518 . . . . 0.0 109.812 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -176.5 156.9 1.57 Allowed 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 123.457 0.473 . . . . 0.0 110.164 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.6 ptm -175.92 128.92 0.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.132 0.895 . . . . 0.0 110.335 177.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.61 164.64 1.05 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.75 109.03 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.534 0.521 . . . . 0.0 109.682 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -167.69 132.58 1.88 Allowed 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.76 -110.37 0.66 Allowed Glycine 0 C--O 1.222 -0.6 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.59 144.18 3.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.912 0.387 . . . . 0.0 110.369 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 172.42 6.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.359 0.599 . . . . 0.0 111.26 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.62 29.82 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 122.047 0.927 . . . . 0.0 111.185 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.97 137.2 4.4 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.4 p -176.01 69.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.203 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 p -165.29 179.29 6.33 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 118.601 -0.714 . . . . 0.0 110.291 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 O-C-N 124.879 1.362 . . . . 0.0 110.753 177.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -41.9 -55.41 3.1 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.316 -0.24 . . . . 0.0 111.169 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -175.17 40.67 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.924 1.345 . . . . 0.0 110.322 176.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -67.9 -34.15 76.1 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 178.645 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.465 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.492 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.515 ' CG1' ' CD2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.492 ' CE ' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.869 HD21 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.433 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.557 ' HB2' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.509 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.674 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.74 -61.35 1.81 Allowed 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p 160.01 48.5 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.568 1.147 . . . . 0.0 111.071 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -85.79 146.16 26.9 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 120.727 -1.233 . . . . 0.0 110.523 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -170.34 125.4 0.75 Allowed 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -177.64 131.75 0.16 Allowed 'General case' 0 C--O 1.207 -1.179 0 O-C-N 123.794 0.684 . . . . 0.0 110.247 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' A' ' 46' ' ' GLU . 48.7 p -161.94 102.67 1.15 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 119.158 0.89 . . . . 0.0 108.936 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.8 m -144.43 10.75 1.46 Allowed 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.147 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.478 ' N ' HD21 ' A' ' 48' ' ' LEU . . . -133.84 -119.55 2.0 Allowed Glycine 0 C--N 1.338 0.67 0 CA-C-O 122.153 0.863 . . . . 0.0 114.742 172.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -86.72 23.72 1.62 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.444 1.116 . . . . 0.0 111.245 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.67 ' OE1' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -79.26 -153.87 0.08 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 120.583 -1.323 . . . . 0.0 110.681 -179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.67 HG12 ' OE1' ' A' ' 46' ' ' GLU . 2.5 p -74.64 49.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 123.981 1.848 . . . . 0.0 110.933 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.649 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -129.44 30.13 4.99 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 119.041 -2.287 . . . . 0.0 109.408 178.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.5 27.09 7.14 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.187 -1.571 . . . . 0.0 112.349 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.439 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.0 OUTLIER 168.19 -54.9 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 C-N-CA 124.079 0.952 . . . . 0.0 111.132 -173.432 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 19.6 Cg_endo -74.93 81.18 2.25 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.871 2.381 . . . . 0.0 111.12 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.92 84.69 0.07 OUTLIER Glycine 0 C--O 1.223 -0.591 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.282 -178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.3 -63.48 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 O-C-N 125.164 1.155 . . . . 0.0 109.27 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.11 76.34 1.34 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 -177.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -130.4 135.56 48.14 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.578 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.82 146.53 26.71 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.816 -0.553 . . . . 0.0 111.025 176.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -126.17 112.93 16.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.921 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -118.37 -79.54 0.6 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 123.487 0.492 . . . . 0.0 109.807 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.85 40.66 0.33 Allowed 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.659 0.742 . . . . 0.0 110.675 -178.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -170.2 86.01 0.12 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 122.083 0.944 . . . . 0.0 108.951 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -66.62 -19.91 65.88 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.549 -0.719 . . . . 0.0 110.9 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.509 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.742 HD11 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.406 HE21 ' HB2' ' A' ' 64' ' ' GLN . 0.9 OUTLIER -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.676 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.84 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.564 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.619 HD13 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.515 ' CD2' ' CG1' ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD23 ' A' ' 95' ' ' LEU . 8.0 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.598 ' CG1' HG11 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.497 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.868 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.403 HH21 ' CD1' ' A' ' 95' ' ' LEU . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.868 HG21 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.497 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.742 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.688 HG21 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.587 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.657 HG23 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.869 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.688 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.657 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.487 HG22 ' H ' ' A' ' 123' ' ' ARG . 9.2 m -153.26 174.86 13.74 Favored 'General case' 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.487 ' H ' HG22 ' A' ' 122' ' ' THR . 1.4 ttt180 -52.39 92.98 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.557 1.143 . . . . 0.0 111.369 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 122' ' ' THR . 54.3 p -77.11 -60.23 2.45 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 115.952 -1.975 . . . . 0.0 106.574 -173.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 C--O 1.298 3.623 0 C-N-CA 127.289 2.236 . . . . 0.0 111.888 -173.802 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.3 71.92 0.6 Allowed 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.544 1.153 . . . . 0.0 109.918 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -57.92 98.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.106 -0.996 . . . . 0.0 111.686 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -161.66 101.18 1.17 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.724 0.773 . . . . 0.0 109.738 -175.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -136.19 146.12 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 171.33 164.92 0.09 Allowed 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 124.975 1.31 . . . . 0.0 110.109 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.48 98.64 2.67 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.777 -0.577 . . . . 0.0 110.02 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.3 90.55 0.1 OUTLIER Glycine 0 C--O 1.222 -0.631 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -141.97 -66.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.413 0.285 . . . . 0.0 111.515 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 -76.76 -69.53 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.055 0.542 . . . . 0.0 111.444 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.81 132.67 34.39 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.843 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.7 -41.3 19.95 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.083 178.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.52 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.54 1.536 . . . . 0.0 112.028 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 p -163.44 147.85 10.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.938 1.295 . . . . 0.0 108.846 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.3 t -58.99 -165.48 0.01 OUTLIER 'General case' 0 C--N 1.34 0.155 0 O-C-N 125.048 1.468 . . . . 0.0 111.266 174.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -37.63 -53.4 1.22 Allowed 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.333 -0.855 . . . . 0.0 113.047 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -172.44 45.06 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.27 1.028 . . . . 0.0 110.632 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -41.11 71.16 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.836 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t -145.0 -44.4 0.23 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 106.65 1.61 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.68 0.752 . . . . 0.0 110.157 -178.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -166.39 167.74 15.55 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.719 0.771 . . . . 0.0 109.809 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 -68.94 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.563 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.66 -175.57 0.53 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.565 1.946 . . . . 0.0 111.566 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.01 -155.03 0.11 Allowed 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.763 1.289 . . . . 0.0 111.092 175.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 66.1 p -70.23 107.93 3.94 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 125.561 1.545 . . . . 0.0 111.717 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 94.88 118.19 3.11 Favored Glycine 0 C--O 1.224 -0.507 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -176.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -156.98 68.98 0.57 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 122.55 1.167 . . . . 0.0 111.142 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 86.96 3.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 122.179 0.99 . . . . 0.0 110.384 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 8.6 t -83.14 47.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 122.33 1.062 . . . . 0.0 109.771 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.86 21.9 0.27 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.584 1.154 . . . . 0.0 111.658 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.74 22.28 0.27 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.9 -55.68 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 125.852 1.661 . . . . 0.0 111.799 -170.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.62 -91.78 0.01 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.46 2.774 . . . . 0.0 107.607 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.49 -57.48 0.19 Allowed Glycine 0 C--O 1.214 -1.143 0 CA-C-O 117.555 -1.691 . . . . 0.0 113.483 -174.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.34 -41.35 75.94 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 126.026 1.73 . . . . 0.0 112.757 175.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -48.8 156.28 0.5 Allowed 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 123.448 0.699 . . . . 0.0 111.6 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 56.59 93.1 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.694 0.759 . . . . 0.0 110.158 -168.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.42 162.19 0.16 Allowed 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.938 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -40.24 111.18 0.18 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.731 0.777 . . . . 0.0 112.759 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -158.17 150.6 22.18 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 122.006 0.908 . . . . 0.0 109.799 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.52 68.91 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 111.444 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.2 t -171.48 97.78 0.19 Allowed 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 120.083 -1.636 . . . . 0.0 109.276 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -63.84 -25.49 68.19 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.462 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.472 ' O ' HG23 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.881 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.799 HG11 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.517 ' HA ' HG22 ' A' ' 124' ' ' THR . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.799 ' HG3' HG11 ' A' ' 73' ' ' VAL . 10.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.81 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.439 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 85' ' ' ILE . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 90' ' ' ILE . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.477 ' CD1' HG11 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.62 ' HA ' HD12 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.566 ' CG2' HD11 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.651 ' CB ' HD13 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.549 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.533 HD12 HD21 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.751 HG21 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.47 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.612 ' HA ' HG13 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.881 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.751 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.501 ' H ' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p -93.88 143.54 26.25 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.11 173.24 2.24 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.517 HG22 ' HA ' ' A' ' 76' ' ' GLU . 15.8 p -145.77 107.51 4.29 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 104.019 -2.586 . . . . 0.0 104.019 -175.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . 0.316 1.0 OUTLIER . . . . . 0 C--O 1.276 2.469 0 CA-C-O 115.313 -2.28 . . . . 0.0 116.565 172.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -161.27 116.96 2.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -176.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.97 142.97 43.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.602 177.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.36 55.42 0.46 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 174.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -143.3 150.09 38.74 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.602 1.161 . . . . 0.0 108.86 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 168.01 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.563 1.545 . . . . 0.0 109.551 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.57 113.18 0.27 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 109.283 177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.39 -110.88 0.49 Allowed Glycine 0 C--O 1.226 -0.401 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -162.14 -55.77 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.504 0.669 . . . . 0.0 111.613 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.57 175.63 11.23 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 125.025 1.33 . . . . 0.0 110.599 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.91 111.27 6.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.789 1.235 . . . . 0.0 110.027 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.21 41.2 0.02 OUTLIER Glycine 0 N--CA 1.468 0.808 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.97 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -142.72 80.0 1.68 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 p -54.94 162.11 1.39 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.728 0.775 . . . . 0.0 111.344 172.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -178.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.587 172.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -35.19 -51.38 0.56 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -168.67 38.42 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.598 1.159 . . . . 0.0 110.653 171.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -57.35 12.97 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.708 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -146.32 -45.11 0.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.64 107.91 1.02 Allowed 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.747 -0.596 . . . . 0.0 109.55 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.9 t -150.5 175.29 12.02 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 124.217 1.007 . . . . 0.0 108.695 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 129.29 5.68 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 174.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 -43.29 133.96 3.93 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.086 0.954 . . . . 0.0 109.382 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.42 -165.3 0.14 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 126.036 2.085 . . . . 0.0 109.331 174.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.7 p -53.97 94.36 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.235 2.214 . . . . 0.0 111.276 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.2 -115.55 0.53 Allowed Glycine 0 C--O 1.222 -0.647 0 O-C-N 121.017 -1.052 . . . . 0.0 110.82 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -82.19 28.61 0.44 Allowed 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.554 176.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.593 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.7 tt0 -37.77 94.92 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.617 1.567 . . . . 0.0 112.735 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.9 t -83.77 49.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 123.077 1.418 . . . . 0.0 108.032 -172.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.593 HD23 ' HG2' ' A' ' 46' ' ' GLU . 0.3 OUTLIER -105.51 -23.17 12.85 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.119 1.768 . . . . 0.0 110.017 178.827 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.45 25.77 8.14 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 125.529 1.531 . . . . 0.0 112.861 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.3 mmt -109.78 86.83 5.01 Favored Pre-proline 0 C--N 1.327 -0.413 0 C-N-CA 124.915 1.286 . . . . 0.0 109.106 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.69 132.64 22.21 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.748 2.299 . . . . 0.0 108.19 177.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.69 90.09 0.27 Allowed Glycine 0 C--O 1.218 -0.848 0 N-CA-C 107.709 -2.156 . . . . 0.0 107.709 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -49.97 -31.65 13.09 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.89 1.345 . . . . 0.0 113.152 173.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.94 34.2 0.29 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 127.148 2.179 . . . . 0.0 113.411 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.472 ' OD1' ' HB3' ' A' ' 67' ' ' CYS . 27.0 m-20 -170.41 159.08 6.84 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 126.658 1.983 . . . . 0.0 109.639 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 95.27 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 176.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -119.09 62.82 0.79 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -173.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.74 -67.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.027 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -141.38 41.29 1.76 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 124.233 1.968 . . . . 0.0 111.192 -177.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.19 37.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.508 -1.37 . . . . 0.0 111.395 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.34 -14.57 4.76 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.775 HD11 HD12 ' A' ' 110' ' ' ILE . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.472 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.582 HG11 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.708 HG23 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.551 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.545 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.615 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.57 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.408 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.452 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.61 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.412 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.782 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.782 HG21 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.58 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.775 HD12 HD11 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.629 HG21 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.596 ' OG ' HD23 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.482 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.582 ' NE ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.452 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.629 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.532 ' HD3' HG13 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.615 HG22 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p -79.9 130.78 35.58 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -141.82 52.01 1.51 Allowed 'General case' 0 C--O 1.219 -0.503 0 O-C-N 121.261 -0.9 . . . . 0.0 109.907 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 59.4 p -58.89 82.08 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.185 1.394 . . . . 0.0 110.397 177.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.306 -1.807 . . . . 0.0 112.113 -179.121 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -159.5 -41.54 0.05 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.887 0.742 . . . . 0.0 110.432 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -164.82 54.39 0.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 122.079 0.943 . . . . 0.0 110.988 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptp -157.33 164.91 37.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 121.671 -0.643 . . . . 0.0 110.906 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -150.68 171.91 16.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.305 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 172.7 135.79 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 123.563 0.539 . . . . 0.0 109.641 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -168.24 1.96 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.279 178.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.39 101.4 0.29 Allowed Glycine 0 C--O 1.218 -0.881 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -166.22 165.64 17.37 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 120.721 0.296 . . . . 0.0 110.635 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' CB ' ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -160.06 166.54 29.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.772 178.264 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -83.59 -170.39 3.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.773 1.296 . . . . 0.0 111.099 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.86 174.69 30.66 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.59 36.34 0.75 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 110.694 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -166.4 173.63 9.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.862 -0.524 . . . . 0.0 110.167 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 16' ' ' GLN . 13.2 m -53.44 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 124.42 1.075 . . . . 0.0 110.321 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ARG . 43.0 tt0 -40.39 -54.13 2.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 121.92 -0.488 . . . . 0.0 110.982 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -177.38 39.0 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.749 0 O-C-N 124.498 1.124 . . . . 0.0 109.935 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -41.26 80.75 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.927 HD13 HG22 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.425 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.438 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.636 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.62 -151.69 0.15 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.8 t -134.06 106.99 7.5 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.254 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.1 p -147.59 -178.98 6.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.809 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -88.34 -169.32 2.51 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.503 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.543 ' O ' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -179.84 145.71 0.23 Allowed 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 117.138 -1.411 . . . . 0.0 110.146 177.403 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.54 ' HA ' HG11 ' A' ' 47' ' ' VAL . 1.2 m -168.27 57.04 0.06 Allowed 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.717 2.511 . . . . 0.0 111.082 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.7 m -145.63 15.59 1.43 Allowed 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.661 0.743 . . . . 0.0 110.475 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -86.8 -123.6 1.64 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -87.02 -49.07 7.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.775 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -153.15 117.08 4.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.045 0.45 . . . . 0.0 110.271 -177.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.543 HG11 ' O ' ' A' ' 41' ' ' ARG . 3.4 t -150.71 62.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 121.913 0.863 . . . . 0.0 109.347 -177.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.475 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.4 OUTLIER -156.62 31.39 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.926 0.87 . . . . 0.0 109.674 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -135.85 161.69 34.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.664 -0.647 . . . . 0.0 110.786 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.6 mtt -73.09 168.28 26.37 Favored Pre-proline 0 N--CA 1.441 -0.888 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.637 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -74.52 128.44 11.88 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.133 1.888 . . . . 0.0 111.648 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.84 -101.67 0.15 Allowed Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -55.86 -43.92 77.58 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 124.761 0.918 . . . . 0.0 110.714 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 55' ' ' ASN . 0.5 OUTLIER -56.13 -172.3 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 124.875 1.359 . . . . 0.0 110.264 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLU . 12.5 t30 -38.32 102.8 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 121.712 -0.617 . . . . 0.0 111.159 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.68 109.74 1.51 Allowed 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -175.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -170.23 145.81 2.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -41.1 -40.1 1.42 Allowed 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 124.783 1.302 . . . . 0.0 110.999 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 166.74 112.88 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 125.17 1.544 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -167.15 79.18 0.2 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.26 -15.16 22.33 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 2.7 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 110' ' ' ILE . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 0.2 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.717 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.425 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.927 HG22 HD13 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.879 HG11 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.442 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.879 ' HB3' HG11 ' A' ' 73' ' ' VAL . 1.1 pt20 -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.704 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.445 ' CD2' ' O ' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.414 ' HB1' ' CE ' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.924 ' HA ' HD12 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB2' ' C ' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD23 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.924 HD12 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.519 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.942 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.521 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.942 HG21 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.707 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.771 HG13 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.585 ' CB ' HD23 ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.504 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.771 ' HA ' HG13 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.669 ' HD2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.746 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.619 ' HB3' HG23 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.664 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.3 OUTLIER -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.547 HG22 ' H ' ' A' ' 123' ' ' ARG . 4.7 m -152.42 178.6 9.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.547 ' H ' HG22 ' A' ' 122' ' ' THR . 4.3 mtt180 -59.4 98.83 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.635 0.584 . . . . 0.0 111.123 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 122' ' ' THR . 19.0 p -91.3 -75.48 0.47 Allowed 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.82 0.7 . . . . 0.0 109.501 -178.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.442 ' OXT' ' HB3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.261 1.696 0 O-C-N 124.542 1.151 . . . . 0.0 110.279 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -140.73 -76.67 0.31 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.559 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 4' ' ' MET . 4.9 p90 -176.13 -163.04 0.1 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.058 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.434 ' N ' ' CD2' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -178.0 166.77 2.03 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 123.095 0.558 . . . . 0.0 111.209 177.248 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -152.81 178.34 9.76 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.442 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 170.73 147.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.637 0.732 . . . . 0.0 109.653 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.34 176.1 9.26 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.786 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -131.83 -113.93 1.55 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -168.92 144.82 3.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.992 0.425 . . . . 0.0 110.789 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.44 167.9 17.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 121.147 0.498 . . . . 0.0 110.562 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -147.26 -177.49 5.71 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.59 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 13' ' ' SER . . . 107.77 155.07 18.77 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 12' ' ' GLY . 0.5 OUTLIER 159.99 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.125 0.57 . . . . 0.0 110.516 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.1 p -166.77 -171.38 1.82 Allowed 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.424 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -56.02 -170.62 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.248 1.023 . . . . 0.0 108.827 -179.108 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.419 ' C ' ' O ' ' A' ' 15' ' ' SER . 50.0 tt0 -40.19 -61.25 0.91 Allowed 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.471 -0.768 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -178.28 40.48 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.985 0.897 . . . . 0.0 110.391 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.437 ' SG ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -78.98 -28.85 43.58 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG22 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.736 ' OD2' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.876 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.577 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t -152.5 -42.77 0.1 Allowed 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -153.29 125.2 7.85 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.302 0.572 . . . . 0.0 109.863 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.6 -163.46 1.79 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.5 0.667 . . . . 0.0 110.214 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.4 ttm-85 -153.65 125.82 7.94 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 122.024 -0.422 . . . . 0.0 110.152 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.62 ' HG3' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -46.49 151.06 0.59 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.402 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.8 t -156.35 24.53 0.35 Allowed 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.043 0.84 . . . . 0.0 110.468 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 t -162.69 143.1 9.64 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.674 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.91 122.07 4.23 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -75.71 -4.28 39.49 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.63 68.56 0.72 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 122.551 1.167 . . . . 0.0 110.187 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.678 ' O ' HG12 ' A' ' 47' ' ' VAL . 47.2 t -142.26 60.36 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 122.985 1.374 . . . . 0.0 108.67 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -119.86 51.88 1.15 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 120.79 -1.194 . . . . 0.0 109.478 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -137.94 161.32 36.98 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.778 -0.576 . . . . 0.0 110.909 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.7 mmt -98.2 160.5 28.1 Favored Pre-proline 0 N--CA 1.44 -0.937 0 O-C-N 124.205 0.941 . . . . 0.0 112.118 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -72.0 132.58 20.04 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.726 2.284 . . . . 0.0 112.482 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.33 -82.76 0.41 Allowed Glycine 0 C--N 1.336 0.57 0 O-C-N 123.919 0.762 . . . . 0.0 111.199 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -167.28 -77.58 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -110.61 119.1 38.04 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.488 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 20.8 t30 -74.24 61.76 0.89 Allowed 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.798 0.809 . . . . 0.0 109.639 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 57' ' ' GLN . 2.3 tt0 -108.87 -76.1 0.62 Allowed 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.067 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' N ' ' CG ' ' A' ' 56' ' ' GLN . 0.7 OUTLIER -111.86 -6.53 14.26 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.019 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.4 -156.83 0.64 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-O 121.198 0.523 . . . . 0.0 110.672 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.33 139.0 39.94 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-O 122.056 0.931 . . . . 0.0 111.004 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.447 ' HB3' ' CA ' ' A' ' 55' ' ' ASN . 12.2 t -166.74 74.34 0.16 Allowed 'General case' 0 C--O 1.199 -1.588 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.89 -22.48 2.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.883 -1.136 . . . . 0.0 110.664 178.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.536 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.084 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.647 ' SG ' HG22 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 1.021 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.429 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.638 HG23 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.435 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.567 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.876 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.593 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.46 ' HA ' ' CE ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' C ' HD12 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.5 ' N ' HD12 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.53 ' O ' HD23 ' A' ' 95' ' ' LEU . 16.4 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.612 HD12 ' C ' ' A' ' 86' ' ' ALA . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' A' ' 96' ' ' HIS . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.533 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.784 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.413 ' NE2' ' HA ' ' A' ' 91' ' ' GLN . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.784 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.763 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 1.084 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.802 HG21 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.538 ' HB3' HD23 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.521 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.565 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 1.021 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.802 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.555 ' OE1' HG22 ' A' ' 124' ' ' THR . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.744 HG23 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m -154.59 -159.19 0.93 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.627 ' H ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -49.1 118.83 2.86 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 122.644 0.377 . . . . 0.0 110.999 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.607 HG23 ' O ' ' A' ' 122' ' ' THR . 74.6 p -110.0 -40.89 4.61 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.65 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.548 0.887 0 O-C-N 125.295 1.622 . . . . 0.0 109.332 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.524 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -152.2 164.9 36.4 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.717 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -57.22 164.93 1.54 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.123 0.889 . . . . 0.0 112.109 177.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mtp -176.69 162.32 2.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.141 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -85.48 150.79 24.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.812 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 167.49 111.07 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 124.548 1.155 . . . . 0.0 110.138 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -141.4 141.99 33.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.842 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.71 -106.16 0.46 Allowed Glycine 0 C--O 1.219 -0.79 0 O-C-N 125.707 1.879 . . . . 0.0 109.555 -176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -148.47 -58.13 0.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.717 0.77 . . . . 0.0 110.052 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.06 -65.04 0.07 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 121.478 -0.764 . . . . 0.0 110.856 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.85 179.5 7.67 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.018 0.527 . . . . 0.0 111.096 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.61 145.68 4.58 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 t -92.94 -23.71 18.65 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.302 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 80' ' ' GLU . 36.1 p -165.18 156.64 14.74 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 124.531 1.132 . . . . 0.0 109.293 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.505 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.3 OUTLIER -61.91 -154.98 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 123.176 1.465 . . . . 0.0 111.044 178.681 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -96.37 -21.99 17.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 119.541 -1.975 . . . . 0.0 111.302 176.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -177.25 34.84 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.558 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.9 t -78.19 -24.38 47.18 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.532 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.502 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CE ' ' O ' ' A' ' 72' ' ' GLN . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CD1' HG22 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HA ' HG21 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.634 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.776 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.425 ' HB2' ' NE2' ' A' ' 89' ' ' GLN . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t -84.92 -46.82 10.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -142.55 -146.5 0.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -179.84 90.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 123.821 0.848 . . . . 0.0 109.489 -175.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -168.83 111.88 0.54 Allowed 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.823 -0.548 . . . . 0.0 109.747 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -176.65 171.05 2.34 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 123.681 0.613 . . . . 0.0 110.211 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 95.8 p -86.1 43.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.006 0.522 . . . . 0.0 111.334 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 41.4 m -70.75 -1.51 11.71 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.61 -0.681 . . . . 0.0 112.173 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.95 -119.83 3.35 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -162.25 -39.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.539 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -127.46 103.44 7.36 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.696 -178.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.0 88.78 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 177.11 -34.36 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.177 0 O-C-N 124.421 1.075 . . . . 0.0 109.892 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.29 2.32 7.07 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.374 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 15.8 mmt -88.64 164.26 32.67 Favored Pre-proline 0 N--CA 1.433 -1.299 0 O-C-N 123.827 0.704 . . . . 0.0 112.403 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -75.53 52.96 3.41 Favored 'Trans proline' 0 C--O 1.241 0.659 0 C-N-CA 123.04 2.493 . . . . 0.0 111.606 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.14 -39.43 0.69 Allowed Glycine 0 N--CA 1.429 -1.772 0 CA-C-O 114.362 -3.465 . . . . 0.0 110.875 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -62.75 1.44 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 126.908 2.181 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -69.55 66.78 0.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 122.636 1.207 . . . . 0.0 110.613 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -85.95 -168.74 2.34 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.522 -1.361 . . . . 0.0 108.835 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.08 -71.0 0.09 Allowed 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 123.928 0.767 . . . . 0.0 112.095 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -115.49 130.01 56.74 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 124.116 0.885 . . . . 0.0 110.488 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.12 -54.17 39.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.15 0.5 . . . . 0.0 111.075 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.8 59.23 2.51 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 123.1 1.428 . . . . 0.0 111.049 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 p -166.04 40.51 0.06 Allowed 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 120.178 -1.576 . . . . 0.0 108.873 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -55.56 -20.38 13.14 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.909 HD11 HD12 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.788 HG22 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.489 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.418 ' N ' ' CG1' ' A' ' 73' ' ' VAL . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.461 ' CB ' HG11 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' CB ' ' A' ' 14' ' ' SER . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.829 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.532 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.829 HG22 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.425 ' NE2' ' HB2' ' A' ' 35' ' ' ARG . 16.8 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' HD23 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.47 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.877 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.877 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.776 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.634 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.909 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.695 HG11 ' HB3' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.794 ' HB2' HD23 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.695 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.448 ' HB3' HG23 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.637 ' HG3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p -93.92 -153.77 0.38 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.408 ' HA ' ' HB2' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -50.86 -36.13 36.24 Favored 'General case' 0 C--O 1.211 -0.937 0 O-C-N 120.759 -1.213 . . . . 0.0 111.898 177.612 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.93 147.33 50.09 Favored 'General case' 0 CA--C 1.489 -1.378 0 O-C-N 124.603 1.189 . . . . 0.0 108.312 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.637 ' OXT' ' HG3' ' A' ' 121' ' ' GLN . 8.2 t30 . . . . . 0 CA--C 1.581 2.151 0 O-C-N 127.324 2.89 . . . . 0.0 111.671 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -149.74 -53.55 0.16 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 124.472 1.107 . . . . 0.0 110.459 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -166.95 119.91 0.98 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.91 0.862 . . . . 0.0 110.69 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.4 ptt? -115.64 133.53 55.94 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.358 -0.839 . . . . 0.0 110.785 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -178.33 170.51 1.72 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.0 p 172.0 137.88 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 123.546 0.529 . . . . 0.0 109.873 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -166.53 131.13 2.13 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -157.42 85.88 0.13 Allowed Glycine 0 C--O 1.222 -0.638 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.33 149.66 38.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.461 -0.199 . . . . 0.0 110.461 178.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.05 162.26 0.31 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.983 0.897 . . . . 0.0 110.375 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -81.81 117.88 22.45 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.396 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.46 100.44 0.26 Allowed Glycine 0 C--N 1.337 0.615 0 N-CA-C 110.304 -1.118 . . . . 0.0 110.304 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.46 72.36 0.83 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.093 0.473 . . . . 0.0 109.868 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.44 ' CB ' ' HG3' ' A' ' 80' ' ' GLU . 19.2 p -62.81 144.1 56.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.589 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -154.19 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 O-C-N 125.91 2.006 . . . . 0.0 110.432 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -46.04 62.08 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 118.846 -2.409 . . . . 0.0 110.707 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -177.42 45.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.703 0.627 . . . . 0.0 109.926 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.18 -35.8 81.5 Favored 'General case' 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.684 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.501 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.684 ' CB ' HG22 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.622 HD21 ' HD3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.461 ' SG ' HD12 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.609 ' OE1' HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.45 ' CD2' HD11 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.76 HD13 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t -85.76 -71.44 0.54 Allowed 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 158.61 89.76 0.0 OUTLIER 'General case' 0 C--N 1.344 0.351 0 CA-C-O 122.196 0.998 . . . . 0.0 110.025 -177.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 m -163.1 -175.17 4.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.749 0.785 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.92 88.03 0.88 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.511 178.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -38.81 109.68 0.11 Allowed 'General case' 0 CA--C 1.529 0.166 0 O-C-N 124.734 1.271 . . . . 0.0 111.549 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.7 m -87.67 89.8 8.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -177.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.526 ' H ' HD22 ' A' ' 48' ' ' LEU . 3.7 m -93.06 -139.68 0.2 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.832 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.524 ' H ' HG22 ' A' ' 43' ' ' THR . . . -91.84 -115.15 2.05 Favored Glycine 0 C--O 1.219 -0.837 0 CA-C-O 122.722 1.179 . . . . 0.0 112.423 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -86.68 24.89 1.35 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.341 -1.682 . . . . 0.0 111.0 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -75.51 -148.73 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.477 -1.389 . . . . 0.0 110.939 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 47' ' ' VAL . 61.2 t -78.92 56.74 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-O 123.562 1.648 . . . . 0.0 108.882 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.526 HD22 ' H ' ' A' ' 43' ' ' THR . 0.6 OUTLIER -140.29 37.36 1.9 Allowed 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 119.716 -1.865 . . . . 0.0 108.959 179.385 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -57.5 170.33 0.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 mtt -174.76 86.44 0.33 Allowed Pre-proline 0 C--N 1.327 -0.385 0 O-C-N 124.102 0.877 . . . . 0.0 111.1 178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.33 -20.09 28.25 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.527 1.484 . . . . 0.0 112.971 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.51 -78.54 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.425 0 CA-C-O 116.336 -2.369 . . . . 0.0 110.821 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -167.4 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 126.134 1.726 . . . . 0.0 109.494 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.95 62.32 1.6 Allowed 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.471 ' ND2' ' HA ' ' A' ' 61' ' ' GLN . 7.5 p30 36.97 -158.53 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.326 1.536 . . . . 0.0 111.236 -177.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -110.26 66.95 0.63 Allowed 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 171.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.7 tp60 -159.95 163.43 34.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -46.86 -57.69 4.67 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 124.173 0.92 . . . . 0.0 110.718 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -169.84 83.44 0.12 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.246 1.022 . . . . 0.0 109.862 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 176.95 94.52 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.23 1.014 . . . . 0.0 109.438 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.471 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 2.2 pt20 -66.16 -30.33 70.79 Favored 'General case' 0 CA--C 1.52 -0.175 0 O-C-N 121.539 -0.725 . . . . 0.0 111.074 178.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.729 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.836 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.456 ' HG2' ' NH1' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' HG3' ' CB ' ' A' ' 14' ' ' SER . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.611 ' HB3' HD22 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.536 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.512 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.628 HD22 ' N ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.736 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.729 HG23 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.581 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.622 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.872 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.538 ' CD ' HG12 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.587 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -94.61 -153.79 0.4 Allowed 'General case' 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.587 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.07 -29.43 69.21 Favored 'General case' 0 C--O 1.209 -1.058 0 O-C-N 119.866 -1.771 . . . . 0.0 111.391 178.198 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -139.95 122.02 15.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.248 -0.882 . . . . 0.0 109.852 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 C--O 1.254 1.306 0 O-C-N 125.525 1.766 . . . . 0.0 111.924 177.822 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.62 0 CA-C-O 117.738 -1.125 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -160.11 -50.76 0.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 125.27 1.606 . . . . 0.0 109.793 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -158.37 -178.96 7.67 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 120.989 -1.069 . . . . 0.0 109.12 -177.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -39.91 102.89 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.603 1.161 . . . . 0.0 111.708 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 175.79 158.55 0.24 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 124.116 0.885 . . . . 0.0 109.863 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.2 111.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.719 0.808 . . . . 0.0 109.897 -178.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.31 119.49 11.45 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.69 -92.16 0.01 OUTLIER Glycine 0 CA--C 1.531 1.056 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.28 132.42 47.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.143 0.973 . . . . 0.0 110.235 178.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.93 162.41 6.99 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.809 177.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.15 178.96 7.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.514 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.39 92.27 0.02 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 123.976 0.798 . . . . 0.0 111.522 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -90.21 54.6 2.82 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.4 p -163.53 149.15 11.32 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 t -59.77 -164.82 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 O-C-N 124.178 0.924 . . . . 0.0 110.587 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -39.56 -47.08 1.86 Allowed 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -175.6 44.78 0.01 OUTLIER 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.78 1.276 . . . . 0.0 110.352 175.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.9 -55.45 10.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.654 HG22 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.654 ' CG ' HG22 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HB3' HG21 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' HD11 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 38' ' ' SER . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD11 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m -86.28 -179.63 6.73 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 7.5 p -125.15 115.46 20.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.377 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 t -165.22 132.68 3.02 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.99 144.63 52.96 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -172.07 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 124.143 0.902 . . . . 0.0 111.945 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 85.2 p -60.92 76.17 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.896 1.331 . . . . 0.0 113.68 175.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 p -142.82 140.69 31.42 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 120.1 -1.625 . . . . 0.0 107.782 -173.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.15 -114.22 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -149.84 49.51 0.93 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 122.372 1.082 . . . . 0.0 110.432 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -140.19 35.63 1.9 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 123.141 1.448 . . . . 0.0 109.895 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.495 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -88.08 28.39 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 O-C-N 120.602 -1.311 . . . . 0.0 110.0 178.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.41 -16.24 22.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.956 0.884 . . . . 0.0 111.207 179.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.88 137.23 38.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.333 -0.855 . . . . 0.0 111.079 175.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 171.86 6.71 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.933 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -74.06 54.16 3.1 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.953 3.102 . . . . 0.0 112.192 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.41 -91.82 0.12 Allowed Glycine 0 C--O 1.221 -0.684 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.02 -55.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.994 1.055 . . . . 0.0 109.15 -178.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.53 106.95 17.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -113.8 27.39 9.57 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 111.043 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.86 -178.03 3.53 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 123.601 0.76 . . . . 0.0 109.621 -178.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -165.59 -69.86 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 110.576 176.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -122.13 177.66 5.25 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.435 0.694 . . . . 0.0 110.321 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.72 87.27 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.593 0.757 . . . . 0.0 111.643 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.46 ' CB ' HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER 169.87 76.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.454 1.102 . . . . 0.0 108.304 -175.291 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -55.8 -26.74 47.66 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.669 -0.645 . . . . 0.0 110.817 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' O ' HG23 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.806 HG22 HD13 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.434 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 125' ' ' ASN . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.452 ' HD2' HG22 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.53 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.585 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.734 HG13 HG11 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.494 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.796 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.796 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.747 HD12 HD11 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.813 HG21 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.477 ' CB ' HD23 ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.727 HG23 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.727 ' HB3' HG23 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.567 ' HB2' HG22 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.708 ' O ' HG23 ' A' ' 124' ' ' THR . 7.1 p -154.84 -178.44 7.21 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -44.62 100.38 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.465 0.706 . . . . 0.0 112.091 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.708 HG23 ' O ' ' A' ' 122' ' ' THR . 11.9 p -118.28 -86.06 0.64 Allowed 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 116.227 -1.844 . . . . 0.0 107.032 -171.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.412 ' CB ' ' HB3' ' A' ' 76' ' ' GLU . 57.1 t30 . . . . . 0 CA--C 1.541 0.598 0 O-C-N 126.093 2.12 . . . . 0.0 111.129 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.86 -62.93 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.364 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.2 132.04 52.67 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.205 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 ttt -74.25 55.26 0.59 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 121.742 0.782 . . . . 0.0 111.24 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -136.52 168.26 19.82 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.518 -0.739 . . . . 0.0 110.029 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 170.12 105.04 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.785 0.802 . . . . 0.0 109.63 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -148.27 35.27 0.81 Allowed 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.898 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.22 -83.12 0.06 OUTLIER Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.2 129.68 15.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.641 0.734 . . . . 0.0 110.347 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -159.7 165.01 33.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.266 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.95 71.74 6.67 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.036 0.922 . . . . 0.0 110.046 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.92 41.03 2.26 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -87.98 -59.81 2.14 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.505 0.669 . . . . 0.0 109.831 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 19' ' ' ARG . 12.1 p -168.73 169.08 10.28 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.374 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.5 173.42 0.39 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 -177.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -44.88 -49.41 10.95 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.316 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.454 ' O ' ' CG ' ' A' ' 20' ' ' GLN . 3.4 tt0 -175.04 34.3 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.494 ' HB3' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.46 -22.41 44.15 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 14' ' ' SER . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.454 ' CG ' ' O ' ' A' ' 17' ' ' GLN . 0.5 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.563 HG12 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.69 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.825 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.694 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.12 -53.35 4.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -166.16 98.24 0.62 Allowed 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.0 m -38.93 102.46 0.02 OUTLIER 'General case' 0 C--O 1.209 -1.048 0 O-C-N 123.921 0.763 . . . . 0.0 111.328 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.52 123.75 0.67 Allowed 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 120.873 -1.142 . . . . 0.0 109.728 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 178.91 138.31 0.09 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.573 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.405 ' HA ' HD13 ' A' ' 48' ' ' LEU . 1.7 m -88.96 93.44 9.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.921 0.763 . . . . 0.0 110.269 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.62 ' OG1' HD22 ' A' ' 48' ' ' LEU . 71.4 p -93.17 -138.56 0.2 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.565 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.741 ' O ' HD21 ' A' ' 48' ' ' LEU . . . -94.0 -122.74 3.57 Favored Glycine 0 N--CA 1.438 -1.191 0 CA-C-O 121.903 0.724 . . . . 0.0 111.922 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -86.38 27.28 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.712 0.768 . . . . 0.0 110.761 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.32 -147.64 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 123.105 1.431 . . . . 0.0 110.936 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.631 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -89.47 36.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 120.493 -1.38 . . . . 0.0 109.795 178.883 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.741 HD21 ' O ' ' A' ' 44' ' ' GLY . 0.8 OUTLIER -110.21 13.89 22.95 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 120.356 -1.465 . . . . 0.0 109.822 179.349 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -98.87 28.35 4.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 C-N-CA 122.835 0.454 . . . . 0.0 110.575 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 mtt -165.39 80.27 1.2 Allowed Pre-proline 0 N--CA 1.444 -0.772 0 CA-C-O 121.274 0.559 . . . . 0.0 110.937 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -71.78 54.41 2.04 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.543 2.162 . . . . 0.0 112.775 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.39 110.12 2.41 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -172.12 -64.44 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.504 0.669 . . . . 0.0 109.538 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -109.86 104.25 13.16 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.28 1.038 . . . . 0.0 108.409 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -179.04 175.05 1.01 Allowed 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.436 178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.19 138.4 2.23 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 124.002 0.814 . . . . 0.0 110.836 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -66.81 71.88 0.09 Allowed 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 123.924 0.765 . . . . 0.0 109.977 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -179.14 126.72 0.09 Allowed 'General case' 0 N--CA 1.426 -1.642 0 C-N-CA 123.454 0.702 . . . . 0.0 110.051 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -45.37 107.57 0.1 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.522 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.3 p -174.77 68.44 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 122.036 0.922 . . . . 0.0 108.815 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -61.9 -14.02 30.29 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.847 -0.533 . . . . 0.0 110.064 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 17.4 mm-40 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.643 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 10.7 mm-40 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.778 HG22 HD13 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.487 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.563 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.825 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.525 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.464 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.624 ' HA ' HD23 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.801 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 103' ' ' VAL . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.801 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.694 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.609 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.77 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.635 HG21 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.737 ' CB ' HD23 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.513 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.63 ' HA ' HG13 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.487 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.635 ' HB3' HG21 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HD2' HG22 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p -91.66 -153.19 0.32 Allowed 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -69.95 -92.91 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.425 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 124' ' ' THR . 2.5 t -58.46 92.61 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.779 0.832 . . . . 0.0 110.931 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.248 0.988 0 O-C-N 124.47 1.106 . . . . 0.0 110.556 -177.996 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.135 0 CA-C-O 115.871 -2.014 . . . . 0.0 106.118 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -172.68 3.94 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 124.867 1.355 . . . . 0.0 109.758 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -159.93 57.46 0.37 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 112.054 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptm -178.26 135.73 0.16 Allowed 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 120.85 -1.156 . . . . 0.0 109.046 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 176.8 174.36 0.4 Allowed 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 124.201 1.0 . . . . 0.0 108.73 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.0 p 173.01 91.42 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.116 1.367 . . . . 0.0 110.437 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -139.92 179.9 6.33 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.796 -1.19 . . . . 0.0 110.655 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -140.74 -111.68 0.92 Allowed Glycine 0 CA--C 1.51 -0.251 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -161.5 151.72 17.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 123.655 0.782 . . . . 0.0 110.025 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -65.34 160.61 21.39 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.282 0.364 . . . . 0.0 111.351 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.3 157.68 30.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.183 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 53.54 81.24 0.06 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.846 0.736 . . . . 0.0 112.543 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.5 t -155.43 46.64 0.5 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.406 1.098 . . . . 0.0 109.412 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.43 157.89 4.72 Favored 'General case' 0 CA--C 1.523 -0.089 0 O-C-N 121.151 -0.968 . . . . 0.0 110.371 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -162.65 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.848 0.859 . . . . 0.0 111.103 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -36.49 -60.42 0.59 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -164.04 50.22 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 124.251 1.977 . . . . 0.0 107.268 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -78.93 -40.57 31.69 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' HG13 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.603 HD13 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.469 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD13 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t -89.38 -156.01 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.6 p -99.55 -179.49 4.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.355 1.074 . . . . 0.0 111.326 173.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.56 -166.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.119 1.368 . . . . 0.0 109.958 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt-85 -169.84 -45.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.928 0.891 . . . . 0.0 110.861 175.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -56.48 140.47 45.94 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.626 0.77 . . . . 0.0 109.414 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.3 t -169.41 133.4 1.35 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 t -64.12 139.71 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.398 0.618 . . . . 0.0 111.526 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.06 -117.61 0.41 Allowed Glycine 0 C--O 1.225 -0.453 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 177.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -148.82 -55.45 0.19 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.678 0.791 . . . . 0.0 110.455 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -143.55 102.33 3.92 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 122.465 1.126 . . . . 0.0 108.479 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 p -140.17 20.03 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.779 1.276 . . . . 0.0 110.752 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 pp -106.64 -13.79 15.2 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.322 -0.861 . . . . 0.0 112.405 178.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.53 12.66 1.73 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.498 1.119 . . . . 0.0 113.355 175.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.71 88.15 0.93 Allowed Pre-proline 0 C--O 1.22 -0.468 0 O-C-N 123.877 0.735 . . . . 0.0 110.333 -176.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -71.39 -14.82 31.19 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 120.995 1.13 . . . . 0.0 112.932 176.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.77 -91.01 0.2 Allowed Glycine 0 C--O 1.224 -0.48 0 C-N-CA 125.601 1.572 . . . . 0.0 109.881 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -163.65 -55.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.233 1.013 . . . . 0.0 110.319 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -104.2 113.33 26.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.476 1.111 . . . . 0.0 109.546 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -166.31 131.62 2.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.395 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -72.21 161.06 31.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.496 -0.753 . . . . 0.0 112.089 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -163.29 83.17 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.558 0.694 . . . . 0.0 110.115 177.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.11 -73.07 0.15 Allowed 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.928 -0.483 . . . . 0.0 110.229 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -124.97 21.48 8.17 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.56 1.544 . . . . 0.0 111.183 -177.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.751 ' HB2' HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -172.88 57.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 124.08 1.895 . . . . 0.0 109.02 -173.15 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -68.04 -22.44 64.95 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 119.64 -1.913 . . . . 0.0 111.332 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.072 HD11 HD12 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.525 HG22 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.525 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.476 ' HB3' HG21 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.669 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.458 ' HA ' HD13 ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.497 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.669 HG22 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.568 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.455 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.586 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.653 HG13 HG11 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.416 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.758 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.758 HG21 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.664 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.664 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.413 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 1.072 HD12 HD11 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.777 HG21 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.722 ' HB2' HD23 ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.427 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.618 ' HA ' HG13 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.441 ' HE ' ' N ' ' A' ' 116' ' ' VAL . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.777 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.563 ' CG ' HG13 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p -95.69 -162.4 0.95 Allowed 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -37.03 -85.97 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -56.06 158.94 3.6 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.068 0.947 . . . . 0.0 111.604 172.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.6 t30 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.116 -1.897 . . . . 0.0 113.12 170.788 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.696 0 CA-C-O 117.847 -1.073 . . . . 0.0 108.547 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -165.18 136.08 3.93 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.862 1.351 . . . . 0.0 109.668 -179.111 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -161.0 167.76 25.85 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.14 155.7 0.08 Allowed 'General case' 0 C--O 1.233 0.189 0 O-C-N 124.418 1.074 . . . . 0.0 112.607 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -86.61 177.77 7.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 166.64 103.11 0.0 OUTLIER 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.528 0.731 . . . . 0.0 110.12 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.42 -172.8 4.17 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 110.526 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.33 -112.08 3.4 Favored Glycine 0 C--O 1.224 -0.519 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -159.39 155.95 27.61 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -161.66 160.96 29.32 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.36 165.22 28.1 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.527 0.517 . . . . 0.0 111.247 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 136.34 100.12 0.58 Allowed Glycine 0 C--O 1.224 -0.503 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 t -177.62 102.35 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 19' ' ' ARG . 41.7 t -170.14 -153.66 0.1 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.44 1.096 . . . . 0.0 108.886 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.58 -153.26 0.15 Allowed 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.589 176.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.97 -53.9 15.68 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.627 0.727 . . . . 0.0 111.042 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.18 41.54 0.27 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.549 1.166 . . . . 0.0 109.375 -178.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -78.6 -59.63 2.7 Favored 'General case' 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.442 ' C ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.418 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.814 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' HD12 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.569 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.601 HD13 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.07 -154.17 0.29 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.7 p -78.28 112.48 15.32 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.566 -0.709 . . . . 0.0 111.046 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 t -41.93 132.28 3.15 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.718 0.407 . . . . 0.0 110.929 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -147.52 69.47 1.15 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -177.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 ttt-85 -176.92 129.37 0.17 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.673 -0.68 . . . . 0.0 110.027 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.98 145.93 2.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.377 1.048 . . . . 0.0 109.395 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 45.1 m -77.33 146.6 36.66 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 123.487 0.492 . . . . 0.0 110.677 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.61 123.6 3.65 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.84 -50.44 66.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.913 0.387 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.48 59.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.146 0.974 . . . . 0.0 110.459 179.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.2 p -89.47 23.01 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.731 0.777 . . . . 0.0 111.286 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mp -124.4 50.3 1.71 Allowed 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.631 0.729 . . . . 0.0 109.643 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.67 159.43 24.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.836 178.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 mmm -42.74 148.15 0.58 Allowed Pre-proline 0 CA--C 1.54 0.563 0 O-C-N 124.029 0.831 . . . . 0.0 112.935 178.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -70.65 125.23 11.46 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 N-CA-C 108.896 -1.232 . . . . 0.0 108.896 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.7 92.48 1.37 Allowed Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.96 -52.74 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 O-C-N 125.01 1.065 . . . . 0.0 109.067 -178.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -108.04 43.18 1.24 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 121.746 0.784 . . . . 0.0 110.543 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -177.11 167.62 2.41 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.082 -1.011 . . . . 0.0 108.93 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -57.46 -80.51 0.02 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 O-C-N 124.059 0.849 . . . . 0.0 112.419 175.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -127.48 159.1 35.58 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.672 0.748 . . . . 0.0 111.314 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.99 95.57 9.56 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.036 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -179.55 31.5 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.846 0.716 . . . . 0.0 111.395 -176.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.5 p 170.74 85.62 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.969 0.89 . . . . 0.0 109.642 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -57.58 -21.17 37.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.487 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.94 HD11 HD12 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.848 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.814 HG23 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.662 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.614 ' HG3' HG11 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.669 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.703 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.436 HG21 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 95' ' ' LEU . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.476 ' OE2' HD13 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.601 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.639 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.94 HD12 HD11 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.737 HG13 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.491 ' O ' HG21 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.479 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.905 HG23 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.589 ' HD3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.702 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.905 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.684 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.48 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.2 m -141.58 -147.55 0.22 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.48 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -36.06 -66.54 0.2 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.332 1.053 . . . . 0.0 110.874 179.685 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.78 140.74 52.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.358 1.036 . . . . 0.0 109.24 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.4 ' ND2' ' H ' ' A' ' 125' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.655 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.84 138.8 32.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.515 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -52.23 131.61 32.79 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.15 0.976 . . . . 0.0 111.041 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.0 ptp -145.62 164.16 32.58 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.667 -0.646 . . . . 0.0 110.658 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.84 174.38 0.62 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.718 1.247 . . . . 0.0 110.433 178.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.58 155.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.029 -1.044 . . . . 0.0 109.282 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mttt -67.25 120.44 13.8 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -155.96 82.44 0.16 Allowed Glycine 0 C--O 1.222 -0.623 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.24 -36.86 14.49 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 124.046 0.498 . . . . 0.0 110.779 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 162.68 0.83 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.367 0.604 . . . . 0.0 110.142 178.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.87 170.55 7.84 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.762 177.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.81 171.15 27.12 Favored Glycine 0 CA--C 1.502 -0.731 0 CA-C-O 116.713 -2.159 . . . . 0.0 111.764 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 160.3 122.45 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.8 0 O-C-N 126.764 2.096 . . . . 0.0 109.83 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.4 p -65.51 135.26 54.92 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 117.158 -1.401 . . . . 0.0 108.336 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.449 ' O ' ' C ' ' A' ' 16' ' ' GLN . 6.0 t -55.1 180.0 0.02 OUTLIER 'General case' 0 C--O 1.24 0.584 0 O-C-N 126.323 2.265 . . . . 0.0 108.854 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.449 ' C ' ' O ' ' A' ' 15' ' ' SER . 20.1 tt0 -42.02 -54.18 3.62 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.075 -1.016 . . . . 0.0 110.136 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 31.8 mt-30 -155.02 56.94 0.66 Allowed 'General case' 0 N--CA 1.439 -0.985 0 O-C-N 123.722 0.639 . . . . 0.0 110.244 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -53.02 6.56 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.453 ' N ' ' HG2' ' A' ' 19' ' ' ARG . 2.6 tt0 -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.686 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.506 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HZ1' ' NE ' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.671 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.876 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.598 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.501 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t -143.86 -159.49 0.99 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.2 p -45.53 116.78 1.24 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.808 0.813 . . . . 0.0 110.748 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.7 p -176.2 104.16 0.07 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 122.753 1.263 . . . . 0.0 109.795 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 -61.05 -172.43 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 O-C-N 120.752 -1.217 . . . . 0.0 110.912 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.95 175.49 0.06 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.79 174.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -89.24 -150.67 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.441 1.115 . . . . 0.0 109.737 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.8 p -79.15 98.82 6.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 123.76 1.743 . . . . 0.0 110.512 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.38 -119.23 0.7 Allowed Glycine 0 C--O 1.222 -0.596 0 O-C-N 119.612 -1.93 . . . . 0.0 110.998 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -150.26 -65.97 0.2 Allowed 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.987 0.463 . . . . 0.0 110.606 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.98 -156.87 0.74 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 47' ' ' VAL . 75.9 t -145.44 31.33 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-O 122.281 1.038 . . . . 0.0 109.805 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 38.4 mt -117.85 26.45 9.67 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.258 -0.901 . . . . 0.0 109.548 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.5 149.97 31.32 Favored 'General case' 0 C--O 1.216 -0.69 0 O-C-N 121.019 -1.051 . . . . 0.0 109.104 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.41 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 3.2 mtm -42.17 -51.28 10.75 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.576 173.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.41 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 28.9 Cg_endo -73.75 57.06 3.64 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.049 2.499 . . . . 0.0 112.197 176.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 121.31 89.08 1.03 Allowed Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -166.77 -74.08 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.644 0.85 . . . . 0.0 109.892 178.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -63.99 85.85 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 124.548 1.155 . . . . 0.0 108.254 -177.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 8.7 t30 -137.94 120.57 16.21 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 -176.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.16 97.46 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 125.602 1.814 . . . . 0.0 112.14 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -169.65 130.45 1.05 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -75.82 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.302 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -135.03 72.0 1.45 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.584 1.183 . . . . 0.0 108.932 -176.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 t -166.66 74.88 0.17 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 122.974 1.369 . . . . 0.0 108.254 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -67.7 -8.28 33.9 Favored 'General case' 0 C--O 1.219 -0.517 0 O-C-N 120.153 -1.592 . . . . 0.0 110.497 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.501 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.896 HD11 HD12 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.429 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.622 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.851 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.534 ' NE ' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.686 ' HB3' HG21 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 15.2 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.568 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.516 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.537 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.607 ' O ' HD23 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.662 HG13 HG11 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.49 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.711 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.711 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.711 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.734 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.896 HD12 HD11 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.511 ' CB ' HD23 ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.653 HG13 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.851 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.707 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.653 ' HD3' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.562 ' OE1' HG21 ' A' ' 124' ' ' THR . 2.9 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 123' ' ' ARG . 6.3 m -140.3 -172.87 3.52 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.673 ' H ' HG22 ' A' ' 122' ' ' THR . 0.5 OUTLIER -39.54 138.94 0.63 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.882 1.363 . . . . 0.0 110.759 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 124' ' ' THR . . . . . 0.562 HG21 ' OE1' ' A' ' 121' ' ' GLN . 19.7 p -129.02 -37.88 1.67 Allowed 'General case' 0 C--N 1.312 -1.034 0 O-C-N 124.246 0.966 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.259 1.581 1 CA-C-O 110.92 -4.372 . . . . 0.0 110.035 -176.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.714 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -161.97 77.32 0.51 Allowed 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 123.948 0.78 . . . . 0.0 110.821 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.75 86.88 0.11 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.42 0.629 . . . . 0.0 110.81 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 mtp -81.43 78.87 8.15 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 121.339 -0.851 . . . . 0.0 110.513 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -94.82 177.18 5.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.9 p 172.7 167.69 0.12 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.401 1.096 . . . . 0.0 110.017 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -141.16 48.65 1.67 Allowed 'General case' 0 N--CA 1.456 -0.125 0 CA-C-O 122.092 0.949 . . . . 0.0 110.985 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -171.25 59.62 0.17 Allowed Glycine 0 CA--C 1.509 -0.302 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.7 158.78 29.28 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.753 177.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.8 157.83 0.05 OUTLIER 'General case' 0 C--N 1.346 0.422 0 CA-C-O 121.944 0.878 . . . . 0.0 111.275 179.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -83.76 109.6 17.64 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.514 -0.741 . . . . 0.0 110.746 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.64 66.41 0.01 OUTLIER Glycine 0 C--N 1.332 0.32 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.7 t -58.79 -62.5 1.83 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.467 0.307 . . . . 0.0 110.708 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.8 p -65.12 -159.82 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 122.196 0.998 . . . . 0.0 112.037 176.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.63 -176.48 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.583 -0.698 . . . . 0.0 111.688 175.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -42.22 -53.98 3.86 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -165.6 38.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.544 1.164 . . . . 0.0 110.721 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -65.54 -47.39 76.05 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.849 HD13 HG22 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.747 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.7 t -161.56 35.29 0.13 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.6 p -148.05 -173.07 4.21 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 120.188 -1.57 . . . . 0.0 111.291 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.8 p -83.57 -173.48 4.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.192 0.996 . . . . 0.0 112.412 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -85.41 109.78 18.68 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.339 -0.851 . . . . 0.0 109.555 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.39 176.77 0.08 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.28 0.562 . . . . 0.0 111.748 176.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 m -78.39 57.61 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.943 0.878 . . . . 0.0 111.562 178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.7 p -93.57 99.42 11.88 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.049 -1.032 . . . . 0.0 108.754 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 92.32 118.47 2.47 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.56 -24.64 64.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.89 0.376 . . . . 0.0 111.282 177.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -113.82 61.51 0.66 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 123.122 1.439 . . . . 0.0 110.01 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.6 OUTLIER -87.8 22.04 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.103 0 O-C-N 120.624 -1.298 . . . . 0.0 111.255 178.206 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.4 51.64 1.2 Allowed 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 122.455 1.121 . . . . 0.0 109.686 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.97 28.25 0.61 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.19 -0.944 . . . . 0.0 112.153 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.05 161.49 51.33 Favored Pre-proline 0 N--CA 1.439 -1.02 0 O-C-N 121.536 -0.727 . . . . 0.0 111.354 -177.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -72.27 -8.91 23.59 Favored 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.763 1.642 . . . . 0.0 112.497 175.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.58 84.6 0.02 OUTLIER Glycine 0 C--N 1.348 1.227 0 O-C-N 125.07 1.481 . . . . 0.0 111.348 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 177.32 -44.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 122.153 0.978 . . . . 0.0 109.124 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.34 65.07 0.71 Allowed 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.037 0.922 . . . . 0.0 109.955 -178.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -172.92 46.02 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.687 -0.633 . . . . 0.0 111.194 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 -176.8 3.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.734 0.778 . . . . 0.0 110.089 -177.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 tm0? -157.58 -70.68 0.1 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 121.972 -0.455 . . . . 0.0 110.231 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -178.8 -74.98 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.633 0.773 . . . . 0.0 110.458 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -137.03 76.67 1.6 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.862 0.839 . . . . 0.0 109.957 -177.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.457 ' OG ' HD13 ' A' ' 63' ' ' LEU . 28.6 t -176.27 96.33 0.06 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.936 0.874 . . . . 0.0 109.575 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.66 -28.15 65.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.618 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.091 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.709 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.849 HG22 HD13 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.426 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.645 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.402 ' N ' HG13 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.645 ' HG3' HG11 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.826 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.51 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.826 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.591 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.452 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.896 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.426 ' HB2' HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.896 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.747 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.583 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 1.091 HD12 HD11 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.423 ' O ' HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.543 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.569 HG13 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.528 ' HD2' HG13 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.714 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.569 ' HB3' HG13 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 116' ' ' VAL . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.599 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -143.18 -155.46 0.6 Allowed 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.599 ' H ' HG22 ' A' ' 122' ' ' THR . 37.8 mtt180 -41.73 149.24 0.13 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.772 1.229 . . . . 0.0 112.041 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.0 p -147.22 -44.0 0.17 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 117.051 -1.452 . . . . 0.0 109.817 -173.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.258 1.534 0 CA-C-O 115.068 -2.396 . . . . 0.0 111.386 -175.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.484 ' N ' ' OD2' ' A' ' 75' ' ' ASP . . . . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.58 141.94 6.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -166.09 105.71 0.68 Allowed 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 123.841 0.713 . . . . 0.0 110.02 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 tmm? -91.77 100.02 12.8 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.887 -0.508 . . . . 0.0 110.117 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -148.84 171.78 15.73 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.782 0.433 . . . . 0.0 110.071 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.82 152.52 0.11 Allowed 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.03 0.932 . . . . 0.0 109.809 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -168.3 142.99 3.45 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -174.55 60.93 0.12 Allowed Glycine 0 C--O 1.218 -0.847 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.08 -68.85 0.05 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.475 0.655 . . . . 0.0 110.985 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -73.09 173.1 9.86 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 122.063 -0.398 . . . . 0.0 110.512 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.4 100.98 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.997 0.903 . . . . 0.0 110.334 178.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.25 -149.41 5.23 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 109.064 -1.615 . . . . 0.0 109.064 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.7 -54.21 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.38 -147.38 0.09 Allowed 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.4 m -62.12 -155.08 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.042 1.737 . . . . 0.0 111.992 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -72.66 -36.26 67.9 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 118.955 -2.341 . . . . 0.0 111.968 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -177.93 37.59 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 125.272 1.429 . . . . 0.0 109.298 -178.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 22' ' ' VAL . 53.3 t -81.8 -52.26 7.3 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 178.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.589 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.589 ' N ' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.528 HG23 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.924 HD21 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.43 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.614 ' OE1' HD11 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.512 ' CD2' HD11 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.17 -42.79 0.18 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 99.7 p -144.01 116.01 8.35 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.9 t -150.92 127.31 10.67 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -168.1 62.07 0.07 Allowed 'General case' 0 C--O 1.234 0.252 0 O-C-N 123.715 0.635 . . . . 0.0 109.838 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -43.04 141.57 1.13 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 123.349 1.547 . . . . 0.0 111.599 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 89.3 p -86.73 98.9 11.4 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 120.396 -1.44 . . . . 0.0 109.475 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 m -139.79 138.02 35.5 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 120.932 -1.105 . . . . 0.0 108.875 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.71 -0.78 51.32 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.818 -0.435 . . . . 0.0 112.868 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -146.55 64.32 1.2 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.211 1.404 . . . . 0.0 109.795 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.55 -155.25 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 123.33 1.538 . . . . 0.0 110.823 176.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 65' ' ' GLN . 1.2 p -85.14 22.33 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 O-C-N 120.999 -1.063 . . . . 0.0 112.399 174.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.83 46.15 1.31 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.124 -0.985 . . . . 0.0 109.884 178.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -130.58 172.93 11.39 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 121.458 -0.776 . . . . 0.0 111.047 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -165.83 78.14 1.21 Allowed Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.12 -16.28 25.39 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 120.958 1.105 . . . . 0.0 112.425 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 139.8 102.1 0.51 Allowed Glycine 0 C--O 1.222 -0.625 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 173.15 114.21 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.97 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.817 1.323 . . . . 0.0 111.926 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -116.59 -167.26 1.26 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -176.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -38.51 152.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 122.578 1.18 . . . . 0.0 113.872 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.2 -32.86 14.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.479 -0.889 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -165.92 -84.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.424 0.69 . . . . 0.0 110.577 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -88.32 86.1 7.0 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 121.375 -0.828 . . . . 0.0 110.806 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.65 52.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.938 0.875 . . . . 0.0 112.134 -174.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.17 -28.47 69.68 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.553 ' HG2' HG22 ' A' ' 47' ' ' VAL . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.564 ' HA ' HG21 ' A' ' 47' ' ' VAL . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.787 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.689 HG11 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.524 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.484 ' OD2' ' N ' ' A' ' 1' ' ' ALA . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.689 ' HG3' HG11 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.556 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.526 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.675 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.57 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.675 HD12 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.455 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.575 ' OG ' HG21 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.44 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.803 HG21 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.581 ' CG ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.646 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.777 ' CD1' HD12 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 119' ' ' MET . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.868 ' HB3' HD21 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.591 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.771 HG23 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.924 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.671 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.771 ' HB3' HG23 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p -71.64 139.84 49.45 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.83 174.64 0.66 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.508 0.723 . . . . 0.0 110.18 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.3 p -149.68 113.4 5.05 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.7 m120 . . . . . 0 C--O 1.253 1.279 0 O-C-N 121.629 -0.669 . . . . 0.0 109.446 177.25 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.39 170.44 10.54 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 123.757 0.661 . . . . 0.0 111.175 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -57.73 133.89 55.76 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.813 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 ttt -152.86 147.88 26.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 173.58 2.28 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 124.011 0.819 . . . . 0.0 110.363 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.6 t -49.36 174.42 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.678 1.227 . . . . 0.0 110.701 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.47 109.07 0.13 Allowed 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 120.848 -1.157 . . . . 0.0 110.302 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.76 55.09 0.23 Allowed Glycine 0 C--O 1.22 -0.767 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.36 -40.48 0.06 Allowed 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 121.678 0.751 . . . . 0.0 110.82 178.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -161.62 -43.98 0.04 OUTLIER 'General case' 0 C--O 1.213 -0.851 0 O-C-N 121.357 -0.839 . . . . 0.0 110.475 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.38 147.1 46.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.211 0.319 . . . . 0.0 110.41 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.75 -161.75 20.11 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -81.37 48.94 1.21 Allowed 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.503 0.668 . . . . 0.0 110.748 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.8 p -166.59 114.15 0.86 Allowed 'General case' 0 C--O 1.215 -0.711 0 CA-C-O 122.012 0.91 . . . . 0.0 110.17 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -155.17 -40.69 0.09 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 116.722 -1.608 . . . . 0.0 110.422 179.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -44.33 -84.79 0.0 OUTLIER 'General case' 0 C--N 1.345 0.388 0 O-C-N 125.803 1.939 . . . . 0.0 110.33 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -157.09 20.4 0.31 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.435 0.636 . . . . 0.0 109.939 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.537 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -80.14 -48.34 13.34 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 -179.255 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.486 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' SG ' HD12 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.647 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.475 ' H ' HD11 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.81 -45.22 11.79 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.3 p -172.21 120.78 0.43 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.669 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -32.63 125.71 0.32 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 122.553 1.168 . . . . 0.0 112.247 174.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.56 -61.4 0.02 OUTLIER 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.125 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.28 116.58 1.45 Allowed 'General case' 0 C--N 1.345 0.386 0 O-C-N 123.655 0.597 . . . . 0.0 109.711 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.5 p -170.34 -151.39 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 124.479 1.112 . . . . 0.0 110.038 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 m -82.33 143.14 31.47 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.696 0.799 . . . . 0.0 110.623 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.87 -115.41 0.06 OUTLIER Glycine 0 C--N 1.333 0.388 0 CA-C-O 122.019 0.788 . . . . 0.0 111.412 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.25 -10.15 39.36 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.147 -0.62 . . . . 0.0 110.169 178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -101.06 54.13 0.84 Allowed 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 123.316 1.531 . . . . 0.0 109.973 178.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -139.63 29.68 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 O-C-N 118.583 -2.573 . . . . 0.0 108.868 -179.451 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.1 35.97 4.59 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 120.481 -1.387 . . . . 0.0 109.328 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.06 29.37 6.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.829 -0.544 . . . . 0.0 111.721 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.466 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER 168.28 -53.73 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.644 0.778 . . . . 0.0 111.021 -175.643 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 17.7 Cg_endo -75.34 86.62 1.43 Allowed 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.515 2.144 . . . . 0.0 111.264 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.72 -90.97 0.08 OUTLIER Glycine 0 C--O 1.218 -0.891 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -76.37 -69.5 0.5 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.18 -179.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.097 0.873 . . . . 0.0 110.04 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.0 m120 59.14 165.11 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 122.794 1.283 . . . . 0.0 110.343 -178.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -43.11 127.36 4.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 111.238 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.47 86.36 1.0 Allowed 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.494 1.121 . . . . 0.0 109.746 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.76 -57.69 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -158.37 50.4 0.4 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 123.112 1.434 . . . . 0.0 110.156 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.2 p -168.55 53.66 0.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.323 -1.486 . . . . 0.0 108.942 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -63.56 -18.47 63.9 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.954 HD11 HD12 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.875 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.448 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.495 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.72 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.751 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 ' H ' ' A' ' 32' ' ' ARG . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.567 ' O ' HD23 ' A' ' 95' ' ' LEU . 16.7 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.735 HD12 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.653 HD23 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . 0.594 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.486 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.716 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.647 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.954 HD12 HD11 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.848 HG21 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.434 ' OG ' HD23 ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.558 ' O ' HG21 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.592 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.745 HG13 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.81 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.848 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.745 ' CG ' HG13 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 121' ' ' GLN . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' THR . . . . . 0.633 HG22 ' H ' ' A' ' 123' ' ' ARG . 4.3 m -94.46 -159.81 0.73 Allowed 'General case' 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.633 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -43.37 -82.77 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.945 -1.097 . . . . 0.0 111.758 -178.862 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.0 p -47.24 162.16 0.06 Allowed 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.195 2.185 . . . . 0.0 110.664 178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.7 t30 . . . . . 0 CA--C 1.57 1.728 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.905 178.869 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.826 HD13 HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.401 ' SG ' HD12 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.848 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.472 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 . . . . . 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.496 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.826 HG22 HD13 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.456 HG23 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.519 HD12 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.848 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.498 HG23 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.517 HD11 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.517 ' CG2' HD11 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.707 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.77 HG21 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.76 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.432 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.77 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.696 HG12 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB3' ' HZ2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.66 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.989 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 . . . . . 0 C--O 1.216 -0.659 0 CA-C-O 120.76 0.314 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.799 HD23 ' OG ' ' A' ' 113' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.811 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.611 ' O ' HD23 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.58 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.696 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.764 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.621 ' OE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.764 HD12 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.471 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.691 HD12 HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.691 HG21 HD12 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.547 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.579 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.74 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.799 ' OG ' HD23 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.475 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.989 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.714 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.806 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.917 HG13 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.409 ' HG2' ' CZ ' ' A' ' 84' ' ' TYR . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.917 ' HB2' HG13 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.514 ' SG ' HD13 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' HD21 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.55 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.749 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.827 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.827 HG23 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 HD12 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.418 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.629 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.572 ' HA ' HD23 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.493 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.723 HD12 HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.723 HG21 HD12 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.739 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.749 HG23 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.771 HG11 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.544 ' CB ' HD21 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.698 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.696 ' NE ' HG11 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.771 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.627 ' HB3' HG23 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p . . . . . 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.562 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG22 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HE2' ' NE2' ' A' ' 72' ' ' GLN . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.893 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.764 ' HB3' HG21 ' A' ' 85' ' ' ILE . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' HD12 ' A' ' 27' ' ' LEU . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.731 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 . . . . . 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.566 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.742 HG22 HD13 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.429 ' NE2' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.893 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.48 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.559 ' HA ' HG22 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.764 HG21 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.679 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.45 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.884 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.731 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.566 HD12 HD21 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.673 HG21 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.809 HG22 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.704 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.673 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.624 ' HB3' HG23 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.809 ' HB2' HG22 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.521 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.73 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.76 HD22 ' H ' ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.877 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.488 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.832 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 . . . . . 0 C--O 1.224 -0.275 0 CA-C-O 122.578 1.18 . . . . 0.0 111.683 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.055 HD11 HD12 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.786 ' O ' HG23 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.521 ' HB3' HG21 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.41 ' CG ' ' HG3' ' A' ' 117' ' ' ARG . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.409 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.73 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.511 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.877 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.571 ' HA ' HD23 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.441 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.641 ' CD1' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.443 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.832 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 1.055 HD12 HD11 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.8 HG21 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD23 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.572 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.617 HG13 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.603 ' HD3' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.409 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.8 ' HB3' HG21 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.617 ' HG2' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p . . . . . 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.465 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.492 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.515 ' CG1' ' CD2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.492 ' CE ' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.869 HD21 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.433 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.557 ' HB2' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.509 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.674 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 CA--C 1.538 0.507 0 CA-C-O 121.54 0.686 . . . . 0.0 110.9 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.509 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.742 HD11 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.676 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.84 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.564 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.619 HD13 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.515 ' CD2' ' CG1' ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.9 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.598 ' CG1' HG11 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.497 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.868 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.403 HH21 ' CD1' ' A' ' 95' ' ' LEU . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.868 HG21 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.497 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.742 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.688 HG21 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.587 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.657 HG23 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.869 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.688 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.657 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 9.2 m . . . . . 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.836 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.651 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t . . . . . 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 . . . . . 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.462 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.472 ' O ' HG23 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.881 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.799 HG11 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.799 ' HG3' HG11 ' A' ' 73' ' ' VAL . 39.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.81 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.439 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 85' ' ' ILE . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 90' ' ' ILE . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.477 ' CD1' HG11 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.62 ' HA ' HD12 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.566 ' CG2' HD11 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.651 ' CB ' HD13 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.549 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.533 HD12 HD21 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.751 HG21 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.47 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.612 ' HA ' HG13 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.881 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.751 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.501 ' H ' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p . . . . . 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.708 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.775 HD11 HD12 ' A' ' 110' ' ' ILE . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.582 HG11 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.708 HG23 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.551 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.545 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.615 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.57 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.408 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.452 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.61 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.412 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.782 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.782 HG21 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.58 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.775 HD12 HD11 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.629 HG21 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.596 ' OG ' HD23 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.482 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.582 ' NE ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.452 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.629 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.532 ' HD3' HG13 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.615 HG22 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p . . . . . 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.927 HD13 HG22 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.425 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.438 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.636 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 110' ' ' ILE . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.401 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 0.0 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.717 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.425 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.927 HG22 HD13 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.879 HG11 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.879 ' HB3' HG11 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.704 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.445 ' O ' ' CD2' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.414 ' HB1' ' CE ' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.924 ' HA ' HD12 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB2' ' C ' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD23 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.924 HD12 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.519 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.942 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.521 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.942 HG21 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.707 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.771 HG13 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.585 ' CB ' HD23 ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.504 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.771 ' HA ' HG13 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.669 ' HD2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.746 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.619 ' HB3' HG23 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.664 ' HB2' HG22 ' A' ' 116' ' ' VAL . 1.5 tt0 -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.437 ' SG ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.736 HG22 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.736 ' OD2' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.876 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.577 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 CA-C-O 120.365 0.126 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.536 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.084 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.647 ' SG ' HG22 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 1.021 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.429 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.638 HG23 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.435 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.567 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.876 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.593 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.46 ' CE ' ' HA ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.612 ' C ' HD12 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.5 ' N ' HD12 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.53 ' O ' HD23 ' A' ' 95' ' ' LEU . 4.2 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.612 HD12 ' C ' ' A' ' 86' ' ' ALA . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' A' ' 96' ' ' HIS . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.533 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.784 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.413 ' NE2' ' HA ' ' A' ' 91' ' ' GLN . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.784 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.763 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 1.084 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.802 HG21 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.538 ' HB3' HD23 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.521 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.565 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 1.021 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.802 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . 0.744 HG23 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m . . . . . 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.558 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.9 t . . . . . 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.532 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.502 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CE ' ' O ' ' A' ' 72' ' ' GLN . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CD1' HG22 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HA ' HG21 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.634 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.776 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.909 HD11 HD12 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.788 HG22 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.489 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.418 ' N ' ' CG1' ' A' ' 73' ' ' VAL . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.461 ' CB ' HG11 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.829 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.532 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.829 HG22 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' HD23 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.47 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.877 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.451 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.877 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.776 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.634 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.909 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.695 HG11 ' HB3' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.794 ' HB2' HD23 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.695 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.448 ' HB3' HG23 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p . . . . . 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.684 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.501 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.684 ' CB ' HG22 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.622 HD21 ' HD3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.461 ' SG ' HD12 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.609 ' OE1' HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.45 ' CD2' HD11 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.76 HD13 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t . . . . . 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.237 0.065 . . . . 0.0 111.074 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.729 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.836 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.456 ' HG2' ' NH1' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.611 ' HB3' HD22 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.536 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.512 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.628 HD22 ' N ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.736 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.729 HG23 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.581 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.622 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.872 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.538 ' CD ' HG12 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.654 HG22 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.654 ' CG ' HG22 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HB3' HG21 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' HD11 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD11 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 . . . . . 0 C--O 1.202 -1.396 0 CA-C-O 121.139 0.495 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' O ' HG23 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.806 HG22 HD13 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.434 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.452 ' HD2' HG22 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.53 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.585 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.734 HG13 HG11 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.494 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.796 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.796 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.747 HD12 HD11 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.813 HG21 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.477 ' CB ' HD23 ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.727 HG23 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.727 ' HB3' HG23 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.567 ' HB2' HG22 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 7.1 p . . . . . 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.494 ' HB3' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.42 ' NH1' ' HB2' ' A' ' 84' ' ' TYR . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.563 HG12 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.69 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.825 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.694 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 . . . . . 0 CA--C 1.533 0.319 0 CA-C-O 120.986 0.422 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.9 mm100 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.643 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 2.5 mm100 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.778 HG22 HD13 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.487 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.563 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.825 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.525 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.464 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.624 ' HA ' HD23 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.801 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.469 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 103' ' ' VAL . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.801 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.694 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.609 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.77 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.635 HG21 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.737 ' CB ' HD23 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.513 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.63 ' HA ' HG13 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . 0.487 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.635 ' HB3' HG21 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HD2' HG22 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.402 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' N ' HE21 ' A' ' 20' ' ' GLN . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' HG13 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.603 HD13 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.469 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.664 HD13 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? . . . . . 0 C--O 1.214 -0.802 0 CA-C-O 119.506 -0.283 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.072 HD11 HD12 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.525 HG22 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.525 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.476 ' HB3' HG21 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.669 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.497 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.669 HG22 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.568 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.455 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.586 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.653 HG13 HG11 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.416 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.758 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.758 HG21 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.664 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.664 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.413 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 1.072 HD12 HD11 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.777 HG21 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.722 ' HB2' HD23 ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.427 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.618 ' HA ' HG13 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.441 ' HE ' ' N ' ' A' ' 116' ' ' VAL . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.777 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.563 ' CG ' HG13 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p . . . . . 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.442 ' C ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' N ' HE21 ' A' ' 20' ' ' GLN . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.418 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.814 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.647 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' HD12 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.569 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.601 HD13 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.487 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 2.2 mp0 -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.94 HD11 HD12 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.848 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.814 HG23 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.662 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.614 ' HG3' HG11 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.669 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.703 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.436 HG21 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 95' ' ' LEU . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.476 ' OE2' HD13 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.601 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.639 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.94 HD12 HD11 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.737 HG13 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.491 ' O ' HG21 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.479 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.905 HG23 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.589 ' HD3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.702 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.905 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.684 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.453 ' HG2' ' N ' ' A' ' 20' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.486 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.486 ' N ' HE21 ' A' ' 20' ' ' GLN . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.686 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.506 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HZ1' ' NE ' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.671 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.876 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.598 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.501 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 121.28 0.562 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.501 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.896 HD11 HD12 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.622 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.851 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.534 ' NE ' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.686 ' HB3' HG21 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 4.1 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.568 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.516 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.537 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.607 ' O ' HD23 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.662 HG13 HG11 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.49 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.711 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.445 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.711 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.445 ' NE2' ' HA ' ' A' ' 102' ' ' ARG . 17.1 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.711 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.734 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.896 HD12 HD11 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.511 ' CB ' HD23 ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.653 HG13 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.851 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.707 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.653 ' HD3' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.457 ' NE2' ' CG1' ' A' ' 116' ' ' VAL . 2.9 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.849 HD13 HG22 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.747 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.593 ' NE2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.593 ' H ' ' NE2' ' A' ' 36' ' ' GLN . 1.7 t . . . . . 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 . . . . . 0 C--O 1.223 -0.321 0 CA-C-O 120.751 0.31 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.091 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.709 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.849 HG22 HD13 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.426 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.645 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.402 ' N ' HG13 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.645 ' HG3' HG11 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.826 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.434 HD13 ' HA ' ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.51 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.826 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.591 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.452 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.896 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.426 ' HB2' HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.896 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.747 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.583 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 1.091 HD12 HD11 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.423 ' O ' HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.543 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.569 HG13 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.528 ' HD2' HG13 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.714 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.569 ' HB3' HG13 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 116' ' ' VAL . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 22' ' ' VAL . 53.3 t . . . . . 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.589 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.589 ' N ' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.528 HG23 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.924 HD21 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.43 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.614 ' OE1' HD11 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.512 ' CD2' HD11 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.787 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.689 HG11 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.524 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.689 ' HG3' HG11 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.556 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.526 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.675 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.57 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.675 HD12 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.455 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.575 ' OG ' HG21 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.44 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.803 HG21 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.581 ' CG ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.646 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.777 ' CD1' HD12 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 119' ' ' MET . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.868 ' HB3' HD21 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.591 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.455 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.771 HG23 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.924 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.671 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.771 ' HB3' HG23 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.537 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.486 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.527 ' SG ' HD12 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.647 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.475 ' H ' HD11 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.495 ' HB2' HE22 ' A' ' 89' ' ' GLN . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 . . . . . 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.954 HD11 HD12 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.875 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.448 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.495 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.72 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.751 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 ' H ' ' A' ' 32' ' ' ARG . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.567 ' O ' HD23 ' A' ' 95' ' ' LEU . 5.6 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.735 HD12 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.653 HD23 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' HIS . . . . . 0.594 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.486 HG11 HG12 ' A' ' 90' ' ' ILE . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.716 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.647 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.954 HD12 HD11 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.848 HG21 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.434 ' OG ' HD23 ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.558 ' O ' HG21 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.592 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.745 HG13 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.81 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.848 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.745 ' CG ' HG13 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 121' ' ' GLN . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -154.07 166.6 32.52 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.529 0.732 . . . . 0.0 110.128 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -172.76 101.15 0.14 Allowed 'General case' 0 C--N 1.33 -0.267 0 O-C-N 124.151 0.907 . . . . 0.0 110.045 -176.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.48 149.19 23.75 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 121.958 -0.464 . . . . 0.0 109.805 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -170.82 167.57 7.52 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.88 136.81 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 124.103 0.961 . . . . 0.0 109.653 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -141.81 161.54 37.71 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.442 0.697 . . . . 0.0 110.196 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.94 108.14 0.52 Allowed Glycine 0 C--O 1.222 -0.615 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 -178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -144.45 142.33 30.21 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 177.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.62 167.45 30.1 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 146.89 31.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.483 0.659 . . . . 0.0 110.271 175.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.74 172.35 30.45 Favored Glycine 0 C--O 1.223 -0.588 0 N-CA-C 110.7 -0.96 . . . . 0.0 110.7 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 m -116.71 -83.55 0.63 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 119.242 -0.409 . . . . 0.0 111.479 179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 63.5 p -63.73 -157.56 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 t -59.78 -153.59 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 173.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -39.19 -63.88 0.51 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.272 -0.892 . . . . 0.0 112.78 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -161.65 48.93 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 122.405 1.097 . . . . 0.0 109.861 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.3 m -76.44 -62.72 1.53 Allowed 'General case' 0 CA--C 1.496 -1.118 0 CA-C-O 114.697 -2.573 . . . . 0.0 106.126 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -37.22 -36.73 0.15 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.948 2.099 . . . . 0.0 112.522 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.02 -78.69 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 124.111 0.965 . . . . 0.0 113.442 171.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -64.96 -25.67 67.97 Favored 'General case' 0 C--N 1.322 -0.594 0 O-C-N 119.733 -1.854 . . . . 0.0 111.39 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG1' ' HA ' ' A' ' 81' ' ' ALA . 4.6 t -56.73 -45.23 82.79 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.898 0 C-N-CA 125.356 1.462 . . . . 0.0 109.698 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.49 32.43 0.13 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 177.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 51.3 mtm180 -148.03 -46.92 0.16 Allowed 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.523 -174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.61 -73.78 0.64 Allowed 'General case' 0 CA--C 1.494 -1.211 0 O-C-N 125.062 1.476 . . . . 0.0 111.337 -173.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.457 ' O ' ' C ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -46.13 150.23 0.62 Allowed 'General case' 0 C--O 1.212 -0.886 0 O-C-N 127.432 2.958 . . . . 0.0 110.549 173.621 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.826 HD13 HG22 ' A' ' 70' ' ' VAL . 0.6 OUTLIER -5.16 84.5 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.933 0 C-N-CA 125.85 1.66 . . . . 0.0 113.417 -174.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.6 t -140.36 25.77 2.21 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 123.735 1.731 . . . . 0.0 108.152 -167.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.67 -31.91 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.354 0 CA-C-O 116.016 -1.945 . . . . 0.0 109.672 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.401 ' SG ' HD12 ' A' ' 27' ' ' LEU . 32.5 m -52.63 -49.41 65.2 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-N 119.966 1.257 . . . . 0.0 111.374 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.848 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -77.23 -29.52 54.16 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.088 -1.007 . . . . 0.0 110.665 176.292 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.1 ttm180 -60.89 -32.06 71.53 Favored 'General case' 0 C--O 1.21 -1.024 0 CA-C-O 115.518 -2.182 . . . . 0.0 112.487 173.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.472 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 46.8 t80 -59.3 -53.53 57.14 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 126.635 1.974 . . . . 0.0 109.857 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 106' ' ' ARG . 3.7 pp -75.4 -24.94 57.24 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 124.408 1.068 . . . . 0.0 111.396 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -68.96 -42.24 76.92 Favored 'General case' 0 C--N 1.338 0.108 0 C-N-CA 122.705 0.402 . . . . 0.0 110.697 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -80.83 -167.79 1.53 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.266 1.426 . . . . 0.0 109.322 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -44.91 12.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.899 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -171.25 143.4 1.87 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.24 150.93 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.424 1.09 . . . . 0.0 111.638 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -155.39 175.38 13.94 Favored 'General case' 0 CA--C 1.506 -0.736 0 O-C-N 121.756 -0.59 . . . . 0.0 109.729 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -53.92 159.16 1.81 Allowed 'General case' 0 C--N 1.333 -0.149 0 O-C-N 123.645 0.591 . . . . 0.0 111.014 176.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.27 -156.21 0.32 Allowed 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.1 p -82.1 129.44 34.81 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 124.961 1.304 . . . . 0.0 111.407 176.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 138.24 118.91 1.7 Allowed Glycine 0 C--O 1.226 -0.388 0 N-CA-C 110.226 -1.15 . . . . 0.0 110.226 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -75.46 1.84 13.04 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 174.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -96.11 61.52 2.1 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 120.7 -1.25 . . . . 0.0 111.326 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 47' ' ' VAL . 69.6 t -150.89 59.31 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 123.571 1.653 . . . . 0.0 108.394 -177.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 48' ' ' LEU . 1.7 pt? -132.11 38.57 3.49 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 120.511 -1.368 . . . . 0.0 109.418 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.58 132.91 26.6 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.9 mtm -73.01 -53.88 4.78 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 124.59 1.182 . . . . 0.0 112.961 172.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -72.92 -18.45 24.41 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.406 2.071 . . . . 0.0 111.609 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.47 108.34 0.16 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.14 -63.83 1.16 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.443 0.64 . . . . 0.0 110.561 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -91.74 74.28 5.79 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.766 0.793 . . . . 0.0 109.733 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.1 t30 -179.31 156.89 0.77 Allowed 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.931 0.892 . . . . 0.0 108.898 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.35 119.87 1.13 Allowed 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.339 0.655 . . . . 0.0 111.683 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.24 92.28 0.08 Allowed 'General case' 0 CA--C 1.515 -0.401 0 O-C-N 124.134 0.896 . . . . 0.0 109.363 -174.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 177.11 138.88 0.07 Allowed 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -177.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -48.59 96.58 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 123.107 1.432 . . . . 0.0 111.902 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 77.8 p -168.48 56.92 0.06 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.971 1.367 . . . . 0.0 108.96 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -61.08 -14.14 21.9 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 122.575 1.179 . . . . 0.0 112.432 175.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 68.8 mt-30 -70.28 -65.09 0.77 Allowed 'General case' 0 N--CA 1.44 -0.967 0 O-C-N 120.586 -1.322 . . . . 0.0 110.911 177.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.76 HD23 ' HB2' ' A' ' 113' ' ' SER . 5.3 mp -64.54 -20.38 66.19 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.455 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -53.47 -33.91 56.01 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 118.449 0.568 . . . . 0.0 111.358 172.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.25 -33.96 77.02 Favored 'General case' 0 C--O 1.211 -0.966 0 CA-C-O 117.521 -1.228 . . . . 0.0 111.454 175.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.496 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.0 t -72.65 -48.63 37.73 Favored 'General case' 0 C--O 1.212 -0.896 0 CA-C-O 117.591 -1.195 . . . . 0.0 109.311 174.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -56.23 -51.67 67.26 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 120.536 1.516 . . . . 0.0 111.462 177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -59.44 -28.0 66.57 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 122.732 1.253 . . . . 0.0 111.789 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -75.59 -48.44 22.29 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 120.218 -1.551 . . . . 0.0 112.211 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.826 HG22 HD13 ' A' ' 27' ' ' LEU . 20.6 t -72.08 -11.16 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.089 0 O-C-N 120.843 -1.161 . . . . 0.0 110.864 176.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.0 -14.03 60.57 Favored 'General case' 0 N--CA 1.443 -0.814 0 O-C-N 121.041 -1.037 . . . . 0.0 111.035 173.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -97.48 7.15 47.03 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 174.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.456 HG23 ' HA ' ' A' ' 70' ' ' VAL . 28.8 t -69.81 146.33 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-O 120.795 0.331 . . . . 0.0 110.134 175.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.78 -64.75 0.97 Allowed 'General case' 0 CA--C 1.496 -1.128 0 CA-C-O 115.456 -2.212 . . . . 0.0 108.816 -178.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 156.1 -44.8 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 O-C-N 127.898 3.249 . . . . 0.0 111.461 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -97.28 -5.47 36.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 122.343 1.068 . . . . 0.0 112.111 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 13.9 m -106.12 -2.15 22.94 Favored 'General case' 0 N--CA 1.417 -2.109 0 CA-C-O 117.094 -1.431 . . . . 0.0 109.057 176.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -61.57 -45.75 92.82 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.575 1.534 . . . . 0.0 110.362 176.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -54.8 5.85 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 120.484 -1.385 . . . . 0.0 108.045 -173.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.28 -27.74 24.35 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.5 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . . . -59.64 -41.41 90.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 171.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.1 mm -70.17 -35.87 65.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.022 171.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.33 -7.59 25.82 Favored 'General case' 0 C--O 1.213 -0.831 0 O-C-N 121.537 -0.727 . . . . 0.0 111.629 176.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -102.19 -64.79 1.03 Allowed 'General case' 0 N--CA 1.437 -1.115 0 C-N-CA 125.075 1.35 . . . . 0.0 110.585 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.519 HD12 ' CB ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -59.21 -50.62 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.057 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -177.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.848 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -76.21 48.12 0.49 Allowed 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.341 1.456 . . . . 0.0 110.303 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -172.93 -51.13 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.195 0 C-N-CA 124.41 1.084 . . . . 0.0 111.805 -176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -57.2 -49.1 77.05 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.77 0.795 . . . . 0.0 109.39 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -21.62 65.69 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.388 1.625 . . . . 0.0 115.388 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.498 HG23 ' HB3' ' A' ' 95' ' ' LEU . 8.3 mt -72.55 -48.77 45.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 124.442 1.097 . . . . 0.0 109.127 174.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -70.49 -36.03 73.6 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 121.377 -0.827 . . . . 0.0 112.65 175.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -74.62 -54.98 6.41 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.352 0.661 . . . . 0.0 111.409 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -64.93 178.43 9.15 Favored Glycine 0 CA--C 1.529 0.912 0 CA-C-O 123.804 1.78 . . . . 0.0 112.598 174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.25 47.51 1.15 Allowed 'General case' 0 C--O 1.211 -0.943 0 O-C-N 120.659 -1.495 . . . . 0.0 111.436 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.517 HD11 ' CG2' ' A' ' 103' ' ' VAL . 1.3 mm? -98.37 86.53 3.65 Favored 'General case' 0 CA--C 1.501 -0.937 0 O-C-N 119.377 -2.077 . . . . 0.0 108.267 -171.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -152.09 -172.16 4.15 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 67.19 -76.56 0.17 Allowed Glycine 0 C--O 1.22 -0.722 0 CA-C-O 118.625 -1.097 . . . . 0.0 111.496 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -165.74 33.13 0.05 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 124.277 1.989 . . . . 0.0 111.014 174.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -118.54 12.79 13.3 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 119.007 -2.308 . . . . 0.0 109.244 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.4 p -87.48 -29.79 21.12 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 120.058 -1.651 . . . . 0.0 110.646 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -25.0 60.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 122.738 1.256 . . . . 0.0 111.233 178.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -68.25 -24.59 64.91 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 120.262 -1.524 . . . . 0.0 111.0 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.517 ' CG2' HD11 ' A' ' 95' ' ' LEU . 0.9 OUTLIER -78.44 -28.36 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 124.04 0.936 . . . . 0.0 109.991 179.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.87 -49.01 76.55 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 123.905 0.753 . . . . 0.0 109.944 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 pt20 -70.11 -33.66 72.12 Favored 'General case' 0 CA--C 1.519 -0.235 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.343 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.499 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -60.63 -55.32 34.75 Favored 'General case' 0 CA--C 1.499 -1.012 0 O-C-N 124.065 0.853 . . . . 0.0 109.059 -177.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -53.51 -38.07 63.38 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 118.769 -0.634 . . . . 0.0 111.409 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -48.19 -34.41 12.48 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 124.843 1.34 . . . . 0.0 115.15 170.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -55.32 -55.83 27.05 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.211 1.004 . . . . 0.0 110.744 175.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.707 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -72.37 -26.97 25.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.54 0 CA-C-O 121.253 0.549 . . . . 0.0 111.484 178.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.77 HG21 ' CB ' ' A' ' 119' ' ' MET . 72.8 t -58.79 -56.89 13.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 CA-C-O 116.953 -1.499 . . . . 0.0 109.738 176.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.3 t -53.48 -24.29 12.62 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 125.212 1.57 . . . . 0.0 112.095 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.76 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -72.29 -77.76 0.09 Allowed 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 123.936 0.894 . . . . 0.0 110.997 174.381 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.2 t -153.23 34.12 0.47 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.165 0.986 . . . . 0.0 109.306 -175.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.432 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -127.83 24.79 5.1 Favored Glycine 0 C--O 1.222 -0.608 0 N-CA-C 110.432 -1.067 . . . . 0.0 110.432 -179.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.669 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.1 t -69.1 98.22 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.511 -0.525 0 C-N-CA 124.897 1.279 . . . . 0.0 111.909 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -141.54 -93.33 0.14 Allowed 'General case' 0 C--O 1.203 -1.355 0 CA-C-O 116.734 -1.603 . . . . 0.0 111.521 -176.712 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -98.84 0.72 44.85 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.604 1.19 . . . . 0.0 112.313 173.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.77 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -98.08 0.98 47.14 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.698 0.761 . . . . 0.0 112.623 177.171 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -157.11 -48.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.002 0.921 . . . . 0.0 110.709 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -164.11 1.13 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 122.533 1.158 . . . . 0.0 110.117 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.478 ' O ' HG23 ' A' ' 124' ' ' THR . 19.5 p -142.65 -177.91 5.53 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.527 1.131 . . . . 0.0 110.369 -177.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.19 136.37 30.31 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 118.781 0.719 . . . . 0.0 111.882 179.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.478 HG23 ' O ' ' A' ' 122' ' ' THR . 26.0 p -136.18 -47.14 0.64 Allowed 'General case' 0 CA--C 1.5 -0.967 0 CA-C-O 115.37 -2.253 . . . . 0.0 108.231 -174.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.247 0.924 0 CA-C-O 112.195 -3.764 . . . . 0.0 110.488 -173.32 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -166.3 152.0 8.58 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -177.25 162.06 1.9 Allowed 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 124.25 0.969 . . . . 0.0 110.298 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.5 ttt 171.51 131.26 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 O-C-N 124.917 1.386 . . . . 0.0 110.462 179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -150.14 166.95 28.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 118.528 -0.748 . . . . 0.0 109.314 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.5 p 167.6 160.02 0.04 OUTLIER 'General case' 0 CA--C 1.503 -0.832 0 O-C-N 125.695 1.872 . . . . 0.0 108.768 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.65 158.35 0.13 Allowed 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.703 1.201 . . . . 0.0 110.3 178.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.45 102.86 1.38 Allowed Glycine 0 C--O 1.228 -0.244 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 -178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -165.98 149.32 7.6 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.507 -0.407 . . . . 0.0 110.363 178.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.98 169.33 23.74 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 116.607 -1.663 . . . . 0.0 109.902 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.36 -162.53 1.57 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.257 0.973 . . . . 0.0 111.308 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.11 72.01 0.81 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 109.312 -1.515 . . . . 0.0 109.312 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 179.44 37.29 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.504 0.668 . . . . 0.0 110.557 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 p -59.49 151.7 23.51 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.407 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -174.85 0.06 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.624 0.726 . . . . 0.0 110.689 178.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -57.11 -42.05 80.1 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.385 -0.822 . . . . 0.0 110.77 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -175.86 40.37 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.171 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -77.67 -25.91 49.9 Favored 'General case' 0 CA--C 1.479 -1.75 0 CA-C-O 112.228 -3.749 . . . . 0.0 105.538 179.029 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.409 ' CZ ' ' HB2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.91 -47.94 2.26 Favored 'General case' 0 C--O 1.202 -1.404 0 CA-C-N 124.146 3.157 . . . . 0.0 111.9 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -55.74 12.27 Favored 'General case' 0 C--O 1.206 -1.235 0 CA-C-O 117.292 -1.337 . . . . 0.0 111.943 172.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.55 -27.1 62.94 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-N 120.896 1.68 . . . . 0.0 114.084 175.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.696 HG12 ' CD2' ' A' ' 84' ' ' TYR . 46.2 t -70.22 -38.56 75.0 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.468 0 C-N-CA 126.772 2.029 . . . . 0.0 107.661 -179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.483 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 9.7 mt-30 -80.94 37.85 0.44 Allowed 'General case' 0 N--CA 1.436 -1.169 0 O-C-N 121.074 -1.016 . . . . 0.0 112.583 178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 35.3 mtt180 -150.28 -44.85 0.13 Allowed 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 123.879 0.872 . . . . 0.0 109.544 -177.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB3' ' HZ2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -126.57 -72.69 0.64 Allowed 'General case' 0 CA--C 1.494 -1.208 0 O-C-N 124.822 1.326 . . . . 0.0 109.283 -172.596 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.66 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -43.34 139.07 2.1 Favored 'General case' 0 CA--C 1.48 -1.722 0 CA-C-O 112.839 -3.458 . . . . 0.0 108.684 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.989 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -4.17 82.79 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.878 0 O-C-N 126.5 2.375 . . . . 0.0 112.894 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.1 t -142.87 33.26 1.39 Allowed 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 125.958 2.79 . . . . 0.0 105.437 -165.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -177.08 -32.17 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.297 0 O-C-N 118.461 -2.649 . . . . 0.0 108.681 -179.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 47.8 m -52.58 -50.42 63.03 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 120.486 1.494 . . . . 0.0 110.527 178.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.472 ' HG3' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.93 -31.33 63.0 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 123.928 1.823 . . . . 0.0 111.09 175.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 17.2 ttm180 -62.03 -31.65 72.06 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 118.189 -2.819 . . . . 0.0 112.295 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' CE2' ' CD1' ' A' ' 63' ' ' LEU . 69.7 t80 -60.16 -47.86 84.14 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.727 2.011 . . . . 0.0 109.315 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.37 -24.09 57.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 124.931 1.395 . . . . 0.0 110.297 177.683 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.31 -42.14 84.18 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.88 -166.14 0.75 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.342 0.591 . . . . 0.0 110.969 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -82.75 -150.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 122.021 0.915 . . . . 0.0 111.324 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.9 p -113.76 51.51 0.86 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.83 0.852 . . . . 0.0 111.03 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.5 p -154.16 151.24 29.0 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 120.397 -1.439 . . . . 0.0 110.528 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 ttm105 -89.6 81.04 6.54 Favored 'General case' 0 CA--C 1.508 -0.654 0 O-C-N 121.71 -0.619 . . . . 0.0 110.507 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -57.95 132.72 54.26 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 116.384 -1.769 . . . . 0.0 109.325 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.8 m -169.67 136.23 1.59 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 126.069 2.106 . . . . 0.0 108.606 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 67.8 m -91.96 5.92 48.27 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.651 0.738 . . . . 0.0 111.468 176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.22 -120.26 0.98 Allowed Glycine 0 N--CA 1.447 -0.573 0 O-C-N 121.234 -0.916 . . . . 0.0 111.345 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -163.37 -49.42 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -136.83 109.78 7.66 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 122.421 1.105 . . . . 0.0 108.983 -178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.405 ' O ' HG13 ' A' ' 47' ' ' VAL . 1.3 p -87.64 24.16 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 122.379 1.085 . . . . 0.0 111.091 177.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.8 mt -105.22 59.18 0.68 Allowed 'General case' 0 C--N 1.326 -0.425 0 O-C-N 120.324 -1.485 . . . . 0.0 108.31 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.36 23.95 13.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 O-C-N 121.422 -0.799 . . . . 0.0 111.81 176.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -143.0 161.35 49.01 Favored Pre-proline 0 N--CA 1.443 -0.783 0 C-N-CA 122.319 0.248 . . . . 0.0 111.548 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.98 68.79 6.45 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.742 2.294 . . . . 0.0 110.202 178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -101.82 21.19 43.07 Favored Glycine 0 C--O 1.206 -1.612 0 CA-C-O 114.507 -3.385 . . . . 0.0 110.249 177.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.89 -43.73 66.38 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 120.3 2.05 . . . . 0.0 110.207 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -82.53 65.97 7.91 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 122.563 1.173 . . . . 0.0 110.158 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -119.37 152.33 36.98 Favored 'General case' 0 N--CA 1.441 -0.889 0 O-C-N 120.967 -1.083 . . . . 0.0 109.256 177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -48.76 131.57 18.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.88 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -134.83 117.28 15.74 Favored 'General case' 0 CA--C 1.504 -0.81 0 O-C-N 124.214 0.946 . . . . 0.0 109.549 -177.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 175.94 -73.51 0.01 OUTLIER 'General case' 0 C--O 1.223 -0.292 0 O-C-N 124.366 1.041 . . . . 0.0 110.121 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -147.75 37.39 0.89 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 123.266 1.508 . . . . 0.0 109.185 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.87 ' CB ' HD22 ' A' ' 63' ' ' LEU . 4.0 p -173.05 67.49 0.03 OUTLIER 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 123.276 1.513 . . . . 0.0 108.789 -178.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -70.5 -27.53 64.27 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 119.99 -1.694 . . . . 0.0 110.342 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -71.6 -30.64 66.04 Favored 'General case' 0 CA--C 1.488 -1.414 0 CA-C-O 114.604 -2.617 . . . . 0.0 110.85 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.87 HD22 ' CB ' ' A' ' 60' ' ' SER . 2.9 mp -53.95 -22.04 9.34 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 121.009 1.731 . . . . 0.0 110.974 176.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -47.72 -33.99 7.72 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -68.98 -34.51 75.43 Favored 'General case' 0 N--CA 1.425 -1.707 0 CA-C-O 115.347 -2.263 . . . . 0.0 109.978 176.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.811 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.5 t -72.02 -50.41 28.81 Favored 'General case' 0 C--O 1.204 -1.341 0 CA-C-N 121.388 1.904 . . . . 0.0 109.096 174.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.2 t -59.34 -49.27 78.45 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 121.413 1.915 . . . . 0.0 110.726 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -59.76 -28.95 67.83 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 121.518 0.675 . . . . 0.0 111.215 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 mm-40 -73.01 -42.96 62.68 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.347 -0.846 . . . . 0.0 111.772 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.811 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -76.59 -14.88 14.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.99 0 O-C-N 120.935 -1.103 . . . . 0.0 108.495 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -73.42 -14.62 61.29 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 121.079 -1.013 . . . . 0.0 110.828 174.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -96.7 0.12 49.18 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 118.087 -0.959 . . . . 0.0 112.21 175.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.66 HG23 ' CB ' ' A' ' 26' ' ' ASP . 1.4 p -68.83 165.44 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.829 0 O-C-N 124.31 1.006 . . . . 0.0 111.459 177.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -78.77 -68.83 0.61 Allowed 'General case' 0 CA--C 1.487 -1.453 0 CA-C-O 115.062 -2.399 . . . . 0.0 109.116 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.427 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 4.4 m-20 154.13 -29.78 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.971 0 O-C-N 128.675 3.734 . . . . 0.0 109.917 -176.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -115.97 -3.28 12.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 O-C-N 119.936 -1.727 . . . . 0.0 110.349 -179.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 92.3 m -108.95 -2.48 18.25 Favored 'General case' 0 N--CA 1.433 -1.281 0 C-N-CA 124.19 0.996 . . . . 0.0 109.03 176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.611 ' O ' HD23 ' A' ' 27' ' ' LEU . 2.4 pt20 -64.29 -38.76 92.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 122.935 1.35 . . . . 0.0 108.666 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.73 -60.14 2.48 Favored 'General case' 0 CA--C 1.484 -1.595 0 O-C-N 118.739 -2.476 . . . . 0.0 108.239 -175.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -46.44 -33.43 3.95 Favored 'General case' 0 C--O 1.213 -0.857 0 O-C-N 125.469 1.731 . . . . 0.0 110.624 175.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.58 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -52.1 -48.08 64.93 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 118.643 -2.536 . . . . 0.0 115.165 171.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 27.1 mm -55.26 -40.17 55.08 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 120.103 -1.623 . . . . 0.0 112.591 170.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.01 -10.45 53.74 Favored 'General case' 0 C--O 1.205 -1.277 0 CA-C-O 122.397 1.094 . . . . 0.0 110.96 176.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.696 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -95.51 -64.41 1.06 Allowed 'General case' 0 N--CA 1.433 -1.308 0 O-C-N 119.007 -2.308 . . . . 0.0 110.223 176.587 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.4 tp -72.77 -52.52 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.584 0 CA-C-O 115.877 -2.011 . . . . 0.0 106.94 -172.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.8 47.71 0.43 Allowed 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 125.509 1.756 . . . . 0.0 110.821 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.764 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -170.24 -53.6 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.244 0 C-N-CA 123.934 0.893 . . . . 0.0 111.324 -178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -60.77 -40.12 91.33 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 121.053 -1.029 . . . . 0.0 108.932 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.621 ' OE1' HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -62.86 -33.54 75.48 Favored 'General case' 0 N--CA 1.424 -1.754 0 CA-C-O 114.756 -2.545 . . . . 0.0 110.511 176.36 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.764 HD12 ' HA ' ' A' ' 87' ' ' GLU . 61.7 mt -59.76 -40.19 81.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 122.734 2.515 . . . . 0.0 110.045 176.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -82.08 -27.04 33.13 Favored 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 120.609 -1.307 . . . . 0.0 112.484 175.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.72 -58.03 3.53 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 121.954 0.883 . . . . 0.0 109.719 -178.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.471 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -69.3 -175.81 13.18 Favored Glycine 0 N--CA 1.436 -1.337 0 CA-C-O 123.651 1.695 . . . . 0.0 112.565 175.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -86.34 44.58 1.15 Allowed 'General case' 0 C--O 1.216 -0.706 0 O-C-N 120.888 -1.36 . . . . 0.0 110.888 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.691 HD12 HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -87.95 7.25 31.88 Favored 'General case' 0 C--N 1.317 -0.815 0 O-C-N 119.383 -2.073 . . . . 0.0 109.822 178.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.7 m170 -82.57 -178.78 7.2 Favored 'General case' 0 C--O 1.213 -0.845 0 O-C-N 121.033 -1.042 . . . . 0.0 112.025 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.14 -71.72 2.92 Favored Glycine 0 C--O 1.223 -0.536 0 CA-C-O 116.846 -2.086 . . . . 0.0 109.826 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -176.82 55.22 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 125.2 2.429 . . . . 0.0 110.42 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -155.18 25.84 0.42 Allowed 'General case' 0 C--N 1.316 -0.875 0 O-C-N 118.384 -2.698 . . . . 0.0 108.979 -176.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.6 t -87.57 -38.04 16.32 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 121.996 0.903 . . . . 0.0 109.917 177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -71.73 -34.28 69.42 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 120.388 -1.445 . . . . 0.0 109.965 -178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -24.25 66.77 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 120.749 -1.22 . . . . 0.0 110.936 175.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.691 HG21 HD12 ' A' ' 95' ' ' LEU . 25.6 t -80.74 -26.46 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 O-C-N 121.191 -0.943 . . . . 0.0 110.19 178.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.63 98.58 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 121.503 -0.748 . . . . 0.0 110.323 177.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -69.0 -34.18 74.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.166 -0.445 . . . . 0.0 110.906 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.547 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.92 -55.06 38.75 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 118.172 -0.918 . . . . 0.0 108.707 -178.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.579 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -55.32 -37.32 67.26 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 117.869 -1.062 . . . . 0.0 110.408 -178.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -46.85 -33.53 6.63 Favored Glycine 0 C--N 1.343 0.932 0 O-C-N 125.229 1.58 . . . . 0.0 114.25 172.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -53.9 -53.37 53.54 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 125.013 1.325 . . . . 0.0 110.9 174.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.74 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.0 mm -74.43 -29.31 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.874 0 O-C-N 121.004 -1.06 . . . . 0.0 110.02 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' HB3' ' A' ' 119' ' ' MET . 88.6 t -56.84 -51.04 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.255 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.817 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 2.0 p -56.17 -24.9 44.4 Favored 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 125.017 1.448 . . . . 0.0 111.938 175.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.799 ' OG ' HD23 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -78.22 -78.73 0.13 Allowed 'General case' 0 N--CA 1.44 -0.975 0 C-N-CA 123.129 0.572 . . . . 0.0 110.858 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 t -147.6 37.4 0.9 Allowed 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.475 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -126.33 22.88 5.85 Favored Glycine 0 C--O 1.222 -0.598 0 N-CA-C 110.079 -1.208 . . . . 0.0 110.079 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.683 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.6 p -68.95 96.96 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 C-N-CA 124.986 1.314 . . . . 0.0 112.407 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.989 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -143.01 -95.35 0.12 Allowed 'General case' 0 CA--C 1.485 -1.526 0 CA-C-O 115.047 -2.406 . . . . 0.0 110.505 -176.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.75 -0.83 50.93 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 125.025 1.453 . . . . 0.0 111.272 174.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.714 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.03 4.51 52.56 Favored 'General case' 0 N--CA 1.441 -0.905 0 O-C-N 123.908 0.755 . . . . 0.0 112.007 178.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.59 -56.98 0.08 Allowed 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.581 0.752 . . . . 0.0 109.79 178.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -95.12 -169.93 2.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 123.215 1.484 . . . . 0.0 111.096 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.652 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -97.13 -165.56 1.28 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.83 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.652 ' H ' HG22 ' A' ' 122' ' ' THR . 3.0 mtm180 -83.95 89.08 7.17 Favored 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 115.46 -2.21 . . . . 0.0 108.209 179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 42.0 p -39.54 -81.74 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 O-C-N 126.755 2.534 . . . . 0.0 115.049 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.427 ' OXT' ' HB3' ' A' ' 75' ' ' ASP . 1.7 m-20 . . . . . 0 C--O 1.241 0.651 0 O-C-N 126.228 2.205 . . . . 0.0 107.915 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.454 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -143.87 -82.51 0.17 Allowed 'General case' 0 C--O 1.234 0.282 0 O-C-N 123.682 0.614 . . . . 0.0 109.66 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -172.93 178.67 2.49 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.12 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -101.29 -172.51 2.18 Favored 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 123.821 0.701 . . . . 0.0 111.992 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.78 160.83 15.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.991 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.0 p 171.72 156.76 0.08 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.407 0.622 . . . . 0.0 109.792 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.0 tttt -169.11 165.96 11.01 Favored 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 88.1 103.51 0.93 Allowed Glycine 0 C--O 1.218 -0.888 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.72 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -166.16 -56.08 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 121.534 0.683 . . . . 0.0 110.369 178.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -159.87 161.42 34.41 Favored 'General case' 0 CA--C 1.514 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 110.96 178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -87.37 -159.99 0.56 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 123.779 0.675 . . . . 0.0 110.676 178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.74 -165.25 25.91 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 110.132 -1.187 . . . . 0.0 110.132 178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.6 t -89.02 29.89 1.0 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.105 0.479 . . . . 0.0 110.91 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.0 -172.18 2.48 Favored 'General case' 0 N--CA 1.446 -0.635 0 O-C-N 121.868 -0.52 . . . . 0.0 110.006 -179.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -54.78 -166.42 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.463 0 O-C-N 124.315 1.009 . . . . 0.0 110.869 177.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.441 ' C ' ' O ' ' A' ' 15' ' ' SER . 2.6 tt0 -40.8 -57.59 1.89 Allowed 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.341 -0.849 . . . . 0.0 110.558 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -177.24 49.29 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 122.936 1.351 . . . . 0.0 109.936 178.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.806 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -78.18 -38.65 42.93 Favored 'General case' 0 CA--C 1.484 -1.578 0 CA-C-O 115.93 -1.986 . . . . 0.0 106.773 179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.9 ttt85 -42.13 -29.95 0.27 Allowed 'General case' 0 C--O 1.202 -1.445 0 CA-C-N 121.634 2.015 . . . . 0.0 110.115 179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -68.68 0.46 Allowed 'General case' 0 N--CA 1.428 -1.554 0 CA-C-N 119.776 1.171 . . . . 0.0 112.295 175.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -58.49 -26.47 63.46 Favored 'General case' 0 C--O 1.199 -1.557 0 O-C-N 120.609 -1.307 . . . . 0.0 110.934 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.917 HG13 ' HB2' ' A' ' 26' ' ' ASP . 94.0 t -61.96 -28.84 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 C-N-CA 126.638 1.975 . . . . 0.0 108.426 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.409 ' HG2' ' CZ ' ' A' ' 84' ' ' TYR . 2.4 mt-30 -72.61 -1.53 16.47 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.393 0.677 . . . . 0.0 111.743 176.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.64 48.83 0.36 Allowed 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 124.121 0.968 . . . . 0.0 110.189 -178.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -174.9 -75.87 0.01 OUTLIER 'General case' 0 CA--C 1.493 -1.24 0 CA-C-O 116.783 -1.58 . . . . 0.0 108.705 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.917 ' HB2' HG13 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -62.31 -149.87 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.204 0 O-C-N 125.22 1.575 . . . . 0.0 108.258 -177.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.761 HD12 HD11 ' A' ' 82' ' ' ILE . 0.5 OUTLIER -62.21 85.0 0.02 OUTLIER 'General case' 0 C--O 1.201 -1.465 0 O-C-N 118.67 -2.519 . . . . 0.0 107.03 -178.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.446 ' N ' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -139.53 45.1 1.94 Allowed 'General case' 0 N--CA 1.441 -0.918 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 -174.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.06 -35.03 0.01 OUTLIER 'General case' 0 CA--C 1.503 -0.855 0 O-C-N 120.784 -1.198 . . . . 0.0 109.314 178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.514 ' SG ' HD13 ' A' ' 27' ' ' LEU . 27.2 m -53.89 -54.91 32.07 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.516 ' CD ' HD21 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -72.2 -32.02 66.41 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 124.524 2.106 . . . . 0.0 110.148 178.574 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.6 tpp85 -60.4 -38.74 84.97 Favored 'General case' 0 C--O 1.201 -1.486 0 O-C-N 117.702 -3.124 . . . . 0.0 109.814 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 43.7 t80 -53.85 -51.63 62.97 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 125.477 1.511 . . . . 0.0 110.501 -179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.739 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -74.4 -26.08 59.87 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 123.632 0.582 . . . . 0.0 109.634 178.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -43.84 72.24 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.87 -166.98 1.11 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.28 1.032 . . . . 0.0 109.945 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 t -84.02 -150.72 0.11 Allowed 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.949 0.881 . . . . 0.0 111.01 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -127.59 40.17 3.74 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.863 0.839 . . . . 0.0 110.351 178.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.25 -166.02 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 122.132 0.968 . . . . 0.0 110.186 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -167.93 97.9 0.45 Allowed 'General case' 0 CA--C 1.506 -0.745 0 O-C-N 121.818 -0.551 . . . . 0.0 110.257 178.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.92 157.46 0.88 Allowed 'General case' 0 CA--C 1.514 -0.406 0 O-C-N 123.469 0.48 . . . . 0.0 110.153 178.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 7.9 t -172.51 144.0 1.43 Allowed 'General case' 0 C--N 1.322 -0.589 0 O-C-N 123.922 0.764 . . . . 0.0 109.822 177.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -70.53 97.43 1.31 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 122.575 1.178 . . . . 0.0 109.819 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.32 -118.23 0.44 Allowed Glycine 0 C--O 1.225 -0.429 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -165.69 -54.31 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.977 0.457 . . . . 0.0 110.768 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.17 119.29 10.09 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.281 1.039 . . . . 0.0 109.236 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.34 53.2 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.548 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.2 OUTLIER -172.93 33.59 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 124.17 1.938 . . . . 0.0 108.736 -179.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.08 28.71 0.89 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 118.172 -2.83 . . . . 0.0 110.513 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -137.82 62.31 33.63 Favored Pre-proline 0 N--CA 1.446 -0.657 0 CA-C-O 121.397 0.618 . . . . 0.0 111.667 178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -72.61 70.89 3.31 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 122.269 1.979 . . . . 0.0 112.141 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.8 -4.31 10.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-O 118.259 -1.301 . . . . 0.0 111.277 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 170.96 108.99 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.363 0 CA-C-O 117.343 -1.313 . . . . 0.0 110.416 -177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -33.76 108.82 0.06 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 123.644 1.688 . . . . 0.0 112.122 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -110.81 33.6 4.48 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 120.312 -1.492 . . . . 0.0 109.039 -177.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -106.37 164.38 12.08 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 121.166 0.508 . . . . 0.0 110.141 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -123.07 -41.52 2.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.333 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.76 -54.6 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.468 0 O-C-N 123.349 0.406 . . . . 0.0 110.448 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.25 86.7 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 123.841 1.782 . . . . 0.0 110.321 -178.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.5 p -171.25 83.7 0.08 Allowed 'General case' 0 C--N 1.319 -0.738 0 O-C-N 119.137 -2.227 . . . . 0.0 108.78 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.49 -33.78 15.33 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 120.857 0.361 . . . . 0.0 110.481 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.55 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -73.11 -60.96 1.99 Allowed 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 119.158 -0.449 . . . . 0.0 110.739 178.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.749 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.8 OUTLIER -50.69 -26.77 5.9 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.423 0.63 . . . . 0.0 109.617 179.163 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -63.33 -42.3 98.96 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.839 -1.163 . . . . 0.0 110.413 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -57.62 -34.31 69.17 Favored 'General case' 0 C--O 1.205 -1.245 0 CA-C-O 117.345 -1.312 . . . . 0.0 109.779 177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.827 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -68.63 -50.65 49.69 Favored 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 120.194 1.361 . . . . 0.0 108.112 178.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.9 t -60.68 -47.2 87.32 Favored 'General case' 0 C--O 1.208 -1.082 0 CA-C-N 120.239 1.381 . . . . 0.0 109.187 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.78 -28.55 69.53 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 124.21 1.004 . . . . 0.0 109.812 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -78.25 -46.59 19.91 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 122.57 1.176 . . . . 0.0 109.851 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.827 HG23 ' O ' ' A' ' 66' ' ' CYS . 3.5 t -75.75 -15.77 15.46 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.199 0 O-C-N 119.122 -2.236 . . . . 0.0 107.579 -179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.0 tttm -77.43 -27.94 52.41 Favored 'General case' 0 N--CA 1.445 -0.706 0 O-C-N 120.325 -1.484 . . . . 0.0 108.385 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -96.66 11.92 33.66 Favored 'General case' 0 C--O 1.205 -1.288 0 CA-C-O 117.373 -1.299 . . . . 0.0 109.626 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HA ' ' A' ' 26' ' ' ASP . 5.6 p -70.71 161.23 4.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.109 0 CA-C-N 121.46 1.936 . . . . 0.0 110.418 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -73.77 0.14 Allowed 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.457 -179.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.0 t70 169.24 -74.9 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.506 0 CA-C-O 123.104 1.43 . . . . 0.0 110.144 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -80.09 -1.33 39.58 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 118.276 -2.765 . . . . 0.0 107.568 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 69.2 m -91.28 1.16 57.31 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.48 -2.013 . . . . 0.0 108.764 176.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.609 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -55.93 -79.82 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 123.797 0.839 . . . . 0.0 109.734 -179.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -52.83 34.93 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 116.606 -1.664 . . . . 0.0 109.074 -179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -43.37 -32.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.363 0 O-C-N 125.012 1.445 . . . . 0.0 112.122 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.642 ' HA ' HG11 ' A' ' 22' ' ' VAL . . . -63.38 -55.88 20.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 123.97 0.908 . . . . 0.0 111.071 173.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.761 HD11 HD12 ' A' ' 27' ' ' LEU . 34.5 mm -56.69 -35.71 46.45 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 O-C-N 120.847 -1.158 . . . . 0.0 110.698 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 118' ' ' CYS . 1.2 mptt -69.29 -8.91 50.42 Favored 'General case' 0 C--O 1.212 -0.892 0 O-C-N 121.624 -0.672 . . . . 0.0 109.932 178.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.418 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.9 OUTLIER -107.96 -67.65 0.95 Allowed 'General case' 0 N--CA 1.434 -1.252 0 C-N-CA 124.752 1.221 . . . . 0.0 110.46 179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 86' ' ' ALA . 7.2 tp -59.86 -53.77 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.248 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -177.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -77.03 54.8 1.06 Allowed 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -172.95 -53.52 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 123.451 0.701 . . . . 0.0 110.843 178.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.75 -50.84 72.24 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.629 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -65.88 -30.07 70.61 Favored 'General case' 0 C--O 1.195 -1.797 0 CA-C-O 116.741 -1.599 . . . . 0.0 109.027 178.831 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.572 ' HA ' HD23 ' A' ' 95' ' ' LEU . 52.2 mt -62.29 -46.48 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 CA-C-N 121.162 1.801 . . . . 0.0 108.884 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -77.21 -37.27 53.77 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.648 -0.658 . . . . 0.0 110.91 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -57.09 6.01 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 121.652 0.739 . . . . 0.0 109.365 -179.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.493 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -66.65 -176.75 7.77 Favored Glycine 0 N--CA 1.435 -1.388 0 CA-C-O 123.256 1.475 . . . . 0.0 111.233 178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -87.91 40.49 0.94 Allowed 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.447 -1.031 . . . . 0.0 110.628 179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.723 HD12 HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -90.02 12.11 18.61 Favored 'General case' 0 C--O 1.204 -1.319 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -179.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -99.16 -176.73 3.4 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 118.535 -2.603 . . . . 0.0 110.875 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.28 -63.37 4.35 Favored Glycine 0 C--O 1.222 -0.603 0 CA-C-O 118.64 -1.089 . . . . 0.0 110.559 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -178.8 36.64 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.491 0 CA-C-O 124.408 2.051 . . . . 0.0 110.104 -179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -140.63 16.6 2.35 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 119.029 -2.294 . . . . 0.0 109.254 -178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.09 -34.05 56.96 Favored 'General case' 0 CA--C 1.505 -0.782 0 O-C-N 120.951 -1.093 . . . . 0.0 110.098 179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -74.77 -43.86 52.66 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.91 -23.12 17.27 Favored 'General case' 0 C--O 1.214 -0.797 0 O-C-N 120.525 -1.359 . . . . 0.0 109.484 177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.723 HG21 HD12 ' A' ' 95' ' ' LEU . 7.4 t -79.58 -26.43 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.123 0 CA-C-O 121.743 0.782 . . . . 0.0 110.217 179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.79 -46.05 91.2 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.528 -1.357 . . . . 0.0 109.916 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -71.91 -30.56 65.49 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.739 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -56.27 -55.53 32.12 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -178.715 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -67.33 -33.32 75.0 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 -175.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.34 -38.81 6.92 Favored Glycine 0 N--CA 1.441 -0.988 0 O-C-N 124.044 0.84 . . . . 0.0 111.656 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -52.14 -52.29 52.62 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.91 -0.759 . . . . 0.0 111.055 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.749 HG23 ' CD2' ' A' ' 63' ' ' LEU . 1.8 mm -74.09 -31.45 29.88 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.771 HG11 ' HB3' ' A' ' 119' ' ' MET . 71.8 t -57.07 -57.67 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 C-N-CA 123.208 0.603 . . . . 0.0 109.411 178.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.4 p -55.6 -23.66 28.71 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.629 0.581 . . . . 0.0 110.445 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.544 ' CB ' HD21 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -77.11 -77.44 0.15 Allowed 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 123.621 0.575 . . . . 0.0 110.298 178.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 6.5 t -148.49 39.63 0.9 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -134.2 26.29 3.4 Favored Glycine 0 C--O 1.217 -0.916 0 O-C-N 120.493 -1.38 . . . . 0.0 110.231 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.698 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -71.99 107.04 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.897 0 C-N-CA 124.255 1.022 . . . . 0.0 112.348 179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.696 ' NE ' HG11 ' A' ' 70' ' ' VAL . 1.2 mmt180 -147.08 -75.88 0.19 Allowed 'General case' 0 C--O 1.18 -2.596 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -174.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.434 ' HB3' ' NZ ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -118.81 -5.24 10.64 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 125.287 1.435 . . . . 0.0 108.924 179.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.771 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.31 10.23 40.13 Favored 'General case' 0 N--CA 1.444 -0.761 0 O-C-N 123.333 0.396 . . . . 0.0 111.399 -179.669 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.627 ' HB3' HG23 ' A' ' 116' ' ' VAL . 2.5 ttt-85 -159.04 -42.16 0.06 Allowed 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 122.951 0.5 . . . . 0.0 110.552 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.94 -164.95 1.52 Allowed 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.804 0.69 . . . . 0.0 110.468 -179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 54.2 p -92.08 -169.24 2.19 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.14 0.576 . . . . 0.0 111.031 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.621 ' C ' HG22 ' A' ' 124' ' ' THR . 0.0 OUTLIER -56.76 83.52 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.47 0 O-C-N 121.271 -0.893 . . . . 0.0 112.386 -179.332 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.621 HG22 ' C ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER 158.74 152.49 0.01 OUTLIER 'General case' 0 C--O 1.238 0.481 0 O-C-N 124.328 1.017 . . . . 0.0 112.176 -170.301 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.5 p30 . . . . . 0 CA--C 1.558 1.27 0 CA-C-O 116.266 -1.826 . . . . 0.0 111.821 175.026 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -157.4 167.66 29.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 118.878 -0.582 . . . . 0.0 109.572 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -159.78 112.09 2.09 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.361 1.038 . . . . 0.0 109.407 -177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -140.65 167.37 22.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.294 0.569 . . . . 0.0 110.376 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 167.24 15.71 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.8 p 171.32 133.66 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 123.858 0.863 . . . . 0.0 109.54 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -163.53 174.88 11.27 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 123.619 0.768 . . . . 0.0 109.942 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 173.33 96.59 0.1 Allowed Glycine 0 C--O 1.221 -0.664 0 N-CA-C 109.704 -1.359 . . . . 0.0 109.704 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -142.8 144.68 32.68 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 177.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.52 166.66 31.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.393 0.677 . . . . 0.0 110.231 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -141.67 156.88 45.62 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.616 0.572 . . . . 0.0 109.835 175.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.91 150.34 3.83 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-O 122.64 1.133 . . . . 0.0 112.562 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.91 78.95 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -177.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -59.42 171.25 0.84 Allowed 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.651 174.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -176.01 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.334 175.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -40.77 -62.69 0.76 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.175 0.988 . . . . 0.0 112.893 -178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -161.37 37.39 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 123.222 1.487 . . . . 0.0 109.672 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.562 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.93 -42.8 69.37 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-O 117.392 -1.289 . . . . 0.0 107.783 177.188 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -43.31 -28.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.88 -76.03 0.09 Allowed 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 124.838 1.255 . . . . 0.0 111.292 173.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -59.42 -26.77 65.44 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-O 116.907 -1.52 . . . . 0.0 112.813 177.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG22 ' CG ' ' A' ' 26' ' ' ASP . 31.5 t -59.44 -36.16 62.77 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 C-N-CA 125.943 1.697 . . . . 0.0 110.458 177.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -61.67 -10.08 7.7 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 172.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 ptt180 -145.98 24.75 1.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.625 1.57 . . . . 0.0 111.841 -175.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' HE2' ' NE2' ' A' ' 72' ' ' GLN . 3.0 ttmt -145.51 -74.24 0.23 Allowed 'General case' 0 CA--C 1.495 -1.159 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.453 -173.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.893 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -63.38 -159.88 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 126.055 2.097 . . . . 0.0 110.703 177.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.764 ' HB3' HG21 ' A' ' 85' ' ' ILE . 2.3 mm? -35.96 96.57 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.781 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.3 t -147.26 33.61 0.89 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.836 1.779 . . . . 0.0 107.187 -168.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.15 -34.89 0.01 OUTLIER 'General case' 0 CA--C 1.498 -1.052 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.27 -179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' HD12 ' A' ' 27' ' ' LEU . 55.6 m -59.05 -52.56 65.22 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 118.737 0.699 . . . . 0.0 111.647 177.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -41.11 74.75 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.029 174.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -56.9 -34.58 68.04 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 117.182 -1.39 . . . . 0.0 112.425 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.481 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.8 t80 -52.99 -46.59 68.37 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 110.738 177.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.731 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.42 -28.78 61.22 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.661 0.6 . . . . 0.0 111.271 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.46 -49.75 57.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 123.471 0.708 . . . . 0.0 111.616 177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -80.94 -173.37 4.21 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.001 1.72 . . . . 0.0 109.38 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.54 -47.52 9.81 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.948 0.88 . . . . 0.0 111.33 177.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.6 p -162.77 100.81 1.01 Allowed 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 106.013 -1.847 . . . . 0.0 106.013 179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.4 m -37.89 155.78 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 123.332 1.539 . . . . 0.0 114.525 169.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -168.89 78.31 0.12 Allowed 'General case' 0 CA--C 1.501 -0.94 0 O-C-N 118.965 -2.335 . . . . 0.0 108.2 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.627 ' HD3' HG21 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -43.85 132.12 5.32 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -178.412 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.2 t -78.01 -152.91 0.06 Allowed 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 125.021 1.451 . . . . 0.0 108.144 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 p -138.45 94.23 2.83 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 125.51 1.524 . . . . 0.0 109.171 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -146.01 12.2 1.66 Allowed Glycine 0 C--O 1.216 -0.999 0 CA-C-O 118.078 -1.401 . . . . 0.0 112.719 178.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -142.75 -85.09 0.16 Allowed 'General case' 0 C--O 1.222 -0.38 0 CA-C-N 118.318 1.059 . . . . 0.0 110.298 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -141.04 27.23 1.98 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 123.85 1.786 . . . . 0.0 110.414 -177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.627 HG21 ' HD3' ' A' ' 41' ' ' ARG . 36.6 t -88.77 17.13 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.491 -1.381 . . . . 0.0 109.801 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.604 ' O ' HD12 ' A' ' 48' ' ' LEU . 1.8 pp -100.5 34.09 2.51 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 120.535 -1.353 . . . . 0.0 109.735 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ttt85 -39.71 151.45 0.04 OUTLIER 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 123.349 0.659 . . . . 0.0 109.529 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -38.39 -53.97 2.93 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 175.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -70.33 -36.87 8.59 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 122.46 2.107 . . . . 0.0 113.033 174.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 76.27 -56.2 3.24 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 126.416 1.96 . . . . 0.0 110.569 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -52.56 -68.37 0.18 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 126.588 1.955 . . . . 0.0 109.89 177.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.49 167.74 10.18 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-O 123.123 1.439 . . . . 0.0 112.052 175.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' HB3' ' NE2' ' A' ' 64' ' ' GLN . 2.2 t30 -131.88 -157.98 0.86 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.222 176.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.66 114.06 0.24 Allowed 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.654 1.182 . . . . 0.0 111.35 174.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -46.52 140.41 4.34 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 124.323 1.015 . . . . 0.0 110.944 -174.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 177.79 131.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -176.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -72.67 55.44 0.37 Allowed 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 122.536 1.16 . . . . 0.0 112.127 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.425 ' HB3' ' HB2' ' A' ' 63' ' ' LEU . 0.3 OUTLIER 172.55 79.89 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.59 1.156 . . . . 0.0 109.278 -177.068 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -56.62 -31.38 64.26 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 122.98 1.371 . . . . 0.0 111.636 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 21.0 mm-40 -77.65 -58.07 3.47 Favored 'General case' 0 CA--C 1.499 -1.003 0 O-C-N 121.341 -0.85 . . . . 0.0 112.692 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.566 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -56.53 -27.49 57.64 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 173.737 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.442 ' NE2' ' HB3' ' A' ' 55' ' ' ASN . 28.3 tt0 -57.26 -35.87 70.27 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 123.862 0.865 . . . . 0.0 110.595 172.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -64.44 -40.05 94.99 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 116.535 -1.697 . . . . 0.0 109.799 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.485 ' SG ' ' CG2' ' A' ' 110' ' ' ILE . 7.3 t -70.05 -48.68 56.9 Favored 'General case' 0 C--O 1.213 -0.847 0 CA-C-N 119.674 1.125 . . . . 0.0 109.922 177.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 t -59.5 -39.94 85.44 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 119.661 1.119 . . . . 0.0 110.79 177.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -68.7 -33.72 74.43 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 122.215 1.007 . . . . 0.0 111.387 173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -73.31 -49.23 28.6 Favored 'General case' 0 C--O 1.214 -0.777 0 O-C-N 120.226 -1.546 . . . . 0.0 110.477 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.742 HG22 HD13 ' A' ' 27' ' ' LEU . 21.5 t -65.97 -15.77 19.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 O-C-N 120.032 -1.668 . . . . 0.0 111.898 174.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 tptm -73.05 -25.71 61.02 Favored 'General case' 0 C--O 1.223 -0.322 0 O-C-N 121.26 -0.9 . . . . 0.0 112.063 172.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.429 ' NE2' ' HE2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -92.49 11.14 27.31 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 174.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.893 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.07 173.88 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 123.826 0.85 . . . . 0.0 110.961 177.794 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -71.5 -72.48 0.22 Allowed 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 116.983 -1.484 . . . . 0.0 110.784 175.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 161.4 -51.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 O-C-N 126.26 2.225 . . . . 0.0 111.077 -176.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -109.88 -6.59 15.18 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.763 1.225 . . . . 0.0 111.833 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 32.1 m -90.97 -10.11 43.57 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-O 118.478 -0.772 . . . . 0.0 110.767 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -58.03 -34.27 69.87 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 122.142 0.972 . . . . 0.0 110.298 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.25 -68.31 0.5 Allowed 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 120.168 -1.583 . . . . 0.0 110.441 -178.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -49.1 -28.98 4.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.48 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.74 -53.53 53.88 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-O 116.827 -1.558 . . . . 0.0 111.393 171.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.559 ' HA ' HG22 ' A' ' 85' ' ' ILE . 5.1 mm -54.33 -45.15 68.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 CA-C-N 120.077 1.308 . . . . 0.0 112.503 169.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.83 -6.38 5.76 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -108.19 -65.41 1.12 Allowed 'General case' 0 C--O 1.204 -1.304 0 C-N-CA 127.621 2.368 . . . . 0.0 109.639 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.764 HG21 ' HB3' ' A' ' 27' ' ' LEU . 6.2 tp -58.39 -29.31 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 C-N-CA 125.397 1.479 . . . . 0.0 111.614 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.76 -75.81 0.09 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 175.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.679 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.0 tt0 -53.29 -26.62 19.19 Favored 'General case' 0 C--O 1.222 -0.393 0 O-C-N 123.669 0.606 . . . . 0.0 112.545 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -54.88 -71.29 0.08 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 127.225 2.21 . . . . 0.0 108.709 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -59.51 -33.83 71.86 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.777 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 87' ' ' GLU . 86.2 mt -54.33 -42.7 58.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 O-C-N 124.536 1.147 . . . . 0.0 110.127 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.64 -50.56 20.42 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 122.89 0.476 . . . . 0.0 110.566 178.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -56.7 17.86 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 122.664 1.221 . . . . 0.0 112.748 -179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.45 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -67.55 175.85 25.2 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 123.889 1.827 . . . . 0.0 113.288 172.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -81.24 36.78 0.43 Allowed 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.472 -1.605 . . . . 0.0 111.846 178.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.884 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -92.12 -2.84 56.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 123.245 1.498 . . . . 0.0 109.935 -177.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.44 168.1 20.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.244 -1.535 . . . . 0.0 112.402 172.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 90.88 -67.54 2.39 Favored Glycine 0 C--O 1.22 -0.72 0 CA-C-O 117.55 -1.695 . . . . 0.0 109.448 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -173.82 54.18 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 124.457 2.075 . . . . 0.0 110.972 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -159.98 25.32 0.17 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.1 -2.25 . . . . 0.0 108.875 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.3 t -92.23 -42.12 10.04 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 123.576 0.75 . . . . 0.0 109.257 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.47 -26.38 68.7 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 123.087 1.423 . . . . 0.0 111.309 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.84 -19.72 63.45 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.822 -1.799 . . . . 0.0 112.575 174.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.884 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -87.38 -29.83 5.67 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 C-N-CA 124.027 0.931 . . . . 0.0 109.44 177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.87 63.05 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.708 0.766 . . . . 0.0 111.965 174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -69.18 -32.89 72.51 Favored 'General case' 0 CA--C 1.536 0.423 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.731 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -66.01 -43.11 88.63 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.747 0.819 . . . . 0.0 110.071 178.392 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -70.08 -38.43 75.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.428 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -49.56 -32.81 16.74 Favored Glycine 0 CA--C 1.528 0.892 0 O-C-N 124.65 1.219 . . . . 0.0 112.764 175.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -54.4 -55.36 29.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 118.008 0.904 . . . . 0.0 111.867 173.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.566 HD12 HD21 ' A' ' 63' ' ' LEU . 2.7 mm -70.23 -28.15 34.66 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.499 0 O-C-N 121.242 -0.911 . . . . 0.0 112.213 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.673 HG21 ' CB ' ' A' ' 119' ' ' MET . 55.4 t -60.43 -58.38 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.92 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.765 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 62.3 p -55.1 -24.56 26.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 118.396 -0.812 . . . . 0.0 112.632 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.38 -78.02 0.13 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.197 0.999 . . . . 0.0 111.825 175.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 4.2 t -145.2 36.38 1.11 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 122.723 1.249 . . . . 0.0 110.88 178.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.488 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.34 25.3 3.31 Favored Glycine 0 C--O 1.224 -0.496 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -177.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.809 HG22 ' HB2' ' A' ' 121' ' ' GLN . 3.2 p -69.78 66.24 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 C-N-CA 126.365 1.866 . . . . 0.0 110.498 177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.704 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -100.29 -90.93 0.31 Allowed 'General case' 0 C--O 1.212 -0.9 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -174.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -106.18 4.71 29.25 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.673 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.58 -1.22 47.43 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.116 0.567 . . . . 0.0 112.394 178.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.624 ' HB3' HG23 ' A' ' 116' ' ' VAL . 18.7 ttt180 -158.5 -45.98 0.06 Allowed 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 124.572 1.149 . . . . 0.0 111.34 178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.809 ' HB2' HG22 ' A' ' 116' ' ' VAL . 3.3 tt0 -88.58 -144.08 0.14 Allowed 'General case' 0 C--O 1.233 0.219 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 3.1 p -142.26 178.51 7.51 Favored 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 125.718 1.607 . . . . 0.0 109.467 -176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -45.43 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.775 1.23 . . . . 0.0 112.349 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -89.49 106.86 18.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 124.912 1.382 . . . . 0.0 108.465 177.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.253 1.281 0 O-C-N 124.448 1.092 . . . . 0.0 111.428 -179.341 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.631 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -167.01 110.91 0.72 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.973 0.892 . . . . 0.0 110.873 -176.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.505 ' CE2' ' HB3' ' A' ' 5' ' ' GLU . 53.1 p90 -71.81 157.09 38.51 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 120.72 -1.238 . . . . 0.0 111.439 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.65 106.21 0.23 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.178 0.513 . . . . 0.0 111.098 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.505 ' HB3' ' CE2' ' A' ' 3' ' ' PHE . 7.5 pt-20 -152.49 168.78 24.41 Favored 'General case' 0 CA--C 1.492 -1.275 0 CA-C-O 116.8 -1.571 . . . . 0.0 109.206 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 172.51 37.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 O-C-N 125.324 1.64 . . . . 0.0 109.303 178.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.25 165.11 24.29 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 119.929 -1.732 . . . . 0.0 111.445 177.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -159.42 -106.97 0.23 Allowed Glycine 0 C--O 1.225 -0.445 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -157.33 158.84 36.76 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.117 0.484 . . . . 0.0 110.511 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -158.32 161.8 37.67 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.536 0.334 . . . . 0.0 110.266 177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -82.7 -163.29 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.419 1.074 . . . . 0.0 111.424 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -41.67 163.32 0.02 OUTLIER Glycine 0 CA--C 1.538 1.503 0 CA-C-O 124.401 2.112 . . . . 0.0 113.161 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.8 m -119.89 -133.85 0.31 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 120.693 -1.475 . . . . 0.0 109.0 -178.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.4 p -168.4 -170.39 1.25 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 124.401 1.08 . . . . 0.0 111.538 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.454 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.9 OUTLIER -70.07 154.0 42.48 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 -176.467 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -60.68 -16.77 42.72 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.188 177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -175.05 83.22 0.03 OUTLIER 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 122.567 1.175 . . . . 0.0 110.34 178.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.454 ' HB2' ' CB ' ' A' ' 15' ' ' SER . 0.1 OUTLIER -158.92 -47.13 0.06 Allowed 'General case' 0 CA--C 1.465 -2.31 1 CA-C-O 111.233 -4.222 . . . . 0.0 105.762 178.757 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.71 -35.4 0.77 Allowed 'General case' 0 C--O 1.207 -1.172 0 CA-C-N 123.487 2.858 . . . . 0.0 111.885 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -54.82 -76.43 0.03 OUTLIER 'General case' 0 C--O 1.21 -1.001 0 O-C-N 124.281 0.988 . . . . 0.0 113.19 170.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -64.95 -26.96 68.53 Favored 'General case' 0 C--O 1.204 -1.325 0 O-C-N 120.419 -1.425 . . . . 0.0 111.993 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.521 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.5 t -63.99 -56.93 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.472 -2.022 0 CA-C-O 112.194 -3.765 . . . . 0.0 103.948 -177.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -69.15 47.49 0.07 Allowed 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 121.59 1.995 . . . . 0.0 112.638 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 45.5 mtm180 -151.03 -52.23 0.13 Allowed 'General case' 0 N--CA 1.432 -1.37 0 O-C-N 116.761 -3.712 . . . . 0.0 110.031 -176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.93 -29.1 8.07 Favored 'General case' 0 C--O 1.207 -1.134 0 O-C-N 125.547 1.779 . . . . 0.0 110.759 179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.73 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -49.63 -164.97 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.955 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 172.627 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.76 HD22 ' H ' ' A' ' 27' ' ' LEU . 1.4 mm? -58.41 76.34 0.01 OUTLIER 'General case' 0 C--O 1.19 -2.034 0 O-C-N 119.069 -2.269 . . . . 0.0 111.559 170.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.9 p -128.42 40.75 3.61 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 118.462 -2.649 . . . . 0.0 106.116 -176.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.87 -35.15 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 120.072 -1.643 . . . . 0.0 109.54 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.91 -45.79 91.42 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.949 0.795 . . . . 0.0 109.685 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.877 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -76.14 -31.03 58.38 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 122.57 1.176 . . . . 0.0 109.451 178.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -66.69 -32.38 73.65 Favored 'General case' 0 C--O 1.204 -1.313 0 O-C-N 119.523 -1.986 . . . . 0.0 109.645 176.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.488 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.4 t80 -55.67 -44.65 77.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 122.069 2.213 . . . . 0.0 110.432 -179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.832 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.9 OUTLIER -75.7 -29.28 58.92 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 124.47 1.106 . . . . 0.0 110.175 177.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -67.21 -48.94 66.36 Favored 'General case' 0 N--CA 1.444 -0.743 0 O-C-N 121.159 -0.963 . . . . 0.0 110.112 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.74 -171.59 2.92 Favored 'General case' 0 N--CA 1.433 -1.313 0 C-N-CA 125.541 1.536 . . . . 0.0 109.732 -178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.15 -63.59 1.28 Allowed 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.873 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.7 t -154.86 83.87 1.09 Allowed 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -39.86 157.17 0.02 OUTLIER 'General case' 0 C--N 1.35 0.616 0 CA-C-O 123.68 1.705 . . . . 0.0 110.89 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.77 125.48 1.19 Allowed 'General case' 0 CA--C 1.492 -1.286 0 O-C-N 118.663 -2.523 . . . . 0.0 108.082 176.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -43.88 133.48 4.87 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 125.324 1.64 . . . . 0.0 110.011 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 55.5 p -70.32 -153.57 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 123.279 1.514 . . . . 0.0 110.41 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.6 t -63.75 141.46 58.76 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.023 -1.048 . . . . 0.0 112.362 174.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 136.01 121.42 2.08 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.51 0.63 11.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 118.358 -0.829 . . . . 0.0 111.441 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.87 55.16 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 124.686 2.184 . . . . 0.0 112.554 177.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.67 ' O ' HD23 ' A' ' 48' ' ' LEU . 41.1 t -147.69 52.01 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 O-C-N 116.907 -3.62 . . . . 0.0 108.504 -173.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.67 HD23 ' O ' ' A' ' 47' ' ' VAL . 1.0 OUTLIER -143.95 51.08 1.32 Allowed 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 -175.919 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.412 ' CG ' ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -36.79 130.56 0.76 Allowed 'General case' 0 C--N 1.349 0.554 0 C-N-CA 123.144 0.577 . . . . 0.0 109.603 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -49.87 -53.6 40.9 Favored Pre-proline 0 C--N 1.327 -0.411 0 O-C-N 124.513 1.133 . . . . 0.0 112.241 176.365 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 49' ' ' ARG . 19.7 Cg_endo -74.36 -43.34 0.52 Allowed 'Trans proline' 0 N--CA 1.441 -1.59 0 CA-C-O 113.937 -2.609 . . . . 0.0 111.332 179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 37.25 82.52 0.01 OUTLIER Glycine 0 C--N 1.343 0.936 0 O-C-N 127.229 2.83 . . . . 0.0 111.875 179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -165.39 -60.37 0.03 OUTLIER 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.158 -178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -73.02 55.38 0.41 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.694 1.197 . . . . 0.0 110.833 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.44 ' HB3' ' CG ' ' A' ' 64' ' ' GLN . 5.3 m120 -161.39 116.58 2.07 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 125.773 1.629 . . . . 0.0 108.37 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -42.1 104.33 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 124.774 1.296 . . . . 0.0 111.283 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.09 91.87 2.87 Favored 'General case' 0 CA--C 1.501 -0.924 0 O-C-N 124.158 0.911 . . . . 0.0 108.654 -174.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 178.86 -72.97 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.944 0.778 . . . . 0.0 110.538 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -122.25 20.42 10.55 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 122.446 1.117 . . . . 0.0 109.97 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -164.61 43.47 0.09 Allowed 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 120.291 -1.506 . . . . 0.0 107.286 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -54.22 -19.5 5.31 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.4 -1.437 . . . . 0.0 111.683 176.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 1.4 mm100 -72.15 -35.09 68.96 Favored 'General case' 0 N--CA 1.424 -1.734 0 O-C-N 119.983 -1.698 . . . . 0.0 112.539 176.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.055 HD11 HD12 ' A' ' 110' ' ' ILE . 3.2 mp -56.9 -30.24 63.75 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 120.883 -1.136 . . . . 0.0 111.31 174.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 55' ' ' ASN . 27.1 tt0 -61.95 -28.4 69.51 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 119.293 -0.384 . . . . 0.0 111.576 174.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.18 -32.35 66.74 Favored 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 114.733 -2.556 . . . . 0.0 109.267 178.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.786 ' O ' HG23 ' A' ' 70' ' ' VAL . 12.2 t -75.89 -45.97 32.61 Favored 'General case' 0 C--O 1.196 -1.757 0 CA-C-N 120.676 1.58 . . . . 0.0 107.797 177.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 t -59.05 -51.73 68.81 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 122.523 2.419 . . . . 0.0 109.685 178.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.418 HD21 ' ND2' ' A' ' 55' ' ' ASN . 3.5 m-80 -58.62 -32.86 69.41 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.4 0.545 . . . . 0.0 111.887 175.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -69.93 -48.99 56.3 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 122.704 1.24 . . . . 0.0 110.88 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.786 HG23 ' O ' ' A' ' 66' ' ' CYS . 4.0 t -71.37 -23.03 22.59 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.064 0 O-C-N 117.11 -3.494 . . . . 0.0 107.799 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.34 -17.44 60.24 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.644 -1.285 . . . . 0.0 110.72 175.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm-40 -91.1 -12.29 36.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 118.8 -0.619 . . . . 0.0 111.999 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 70' ' ' VAL . 0.3 OUTLIER -67.96 171.41 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 O-C-N 123.753 0.658 . . . . 0.0 110.779 177.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -66.05 -81.78 0.03 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 117.684 -1.151 . . . . 0.0 109.943 177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 156.39 -26.67 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 O-C-N 126.066 2.104 . . . . 0.0 111.016 -175.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.05 -3.48 14.0 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.521 ' HB3' HG21 ' A' ' 22' ' ' VAL . 94.4 m -114.45 -0.78 13.65 Favored 'General case' 0 N--CA 1.427 -1.587 0 CA-C-O 116.887 -1.53 . . . . 0.0 109.09 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.432 ' CD ' ' O ' ' A' ' 123' ' ' ARG . 5.2 pt20 -60.96 -40.24 92.6 Favored 'General case' 0 C--O 1.211 -0.951 0 CA-C-N 120.057 1.299 . . . . 0.0 108.65 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.409 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -76.24 -58.47 3.26 Favored 'General case' 0 CA--C 1.482 -1.647 0 O-C-N 118.028 -2.92 . . . . 0.0 108.636 -177.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.94 -20.9 6.82 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 124.483 1.115 . . . . 0.0 111.141 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.73 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -68.2 -40.88 82.06 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-O 123.461 1.6 . . . . 0.0 113.591 172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.496 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 7.2 mm -59.27 -35.02 55.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 O-C-N 117.756 -3.09 . . . . 0.0 111.073 172.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.68 -9.83 58.02 Favored 'General case' 0 C--O 1.204 -1.3 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.412 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -94.75 -62.51 1.31 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.437 1.495 . . . . 0.0 109.344 177.239 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.511 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.1 tp -69.68 -50.55 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.092 0 CA-C-O 117.619 -1.182 . . . . 0.0 107.997 -172.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.877 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -77.25 50.22 0.75 Allowed 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 125.303 1.441 . . . . 0.0 110.519 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -173.9 -44.82 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.181 0.992 . . . . 0.0 110.947 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -68.44 -43.27 77.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 120.109 -1.619 . . . . 0.0 108.099 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.575 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -68.48 -22.28 64.57 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-O 114.918 -2.468 . . . . 0.0 108.502 178.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.571 ' HA ' HD23 ' A' ' 95' ' ' LEU . 43.3 mm -65.89 -45.63 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.805 0 CA-C-N 122.87 2.577 . . . . 0.0 109.431 -178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.58 -29.06 45.99 Favored 'General case' 0 N--CA 1.437 -1.107 0 O-C-N 121.861 -0.524 . . . . 0.0 111.969 175.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.7 -55.68 5.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 122.738 1.256 . . . . 0.0 109.432 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.441 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -68.62 -174.89 9.6 Favored Glycine 0 N--CA 1.434 -1.467 0 O-C-N 119.977 -1.702 . . . . 0.0 111.875 178.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -85.73 39.23 0.79 Allowed 'General case' 0 C--O 1.216 -0.684 0 O-C-N 121.002 -1.293 . . . . 0.0 111.691 177.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.641 ' CD1' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -89.58 17.39 6.44 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 119.798 -1.814 . . . . 0.0 109.678 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 50.1 m-70 -79.52 175.47 10.58 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-O 121.586 0.708 . . . . 0.0 111.515 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 87.22 -80.91 1.69 Allowed Glycine 0 C--O 1.221 -0.686 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -172.64 32.51 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 124.567 2.127 . . . . 0.0 109.634 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.88 25.5 9.13 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 118.253 -2.779 . . . . 0.0 108.813 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.443 ' HB2' ' CG2' ' A' ' 90' ' ' ILE . 1.2 t -85.1 -33.83 22.33 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 119.831 -1.793 . . . . 0.0 110.741 177.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.87 -27.78 65.1 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -72.13 -23.83 61.37 Favored 'General case' 0 C--O 1.216 -0.71 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.641 HG21 ' CD1' ' A' ' 95' ' ' LEU . 3.6 t -83.18 -24.52 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 O-C-N 118.95 -2.344 . . . . 0.0 108.229 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.95 -36.44 82.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.684 -0.635 . . . . 0.0 110.035 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.61 -27.59 63.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 119.607 -0.235 . . . . 0.0 110.899 177.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.832 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -64.98 -55.17 20.66 Favored 'General case' 0 C--O 1.208 -1.12 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -177.718 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -56.81 -35.21 68.5 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-O 116.498 -1.715 . . . . 0.0 111.346 -179.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -42.64 -33.01 1.43 Allowed Glycine 0 CA--C 1.531 1.083 0 O-C-N 125.536 1.772 . . . . 0.0 113.859 170.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -56.04 -53.74 53.29 Favored 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 121.375 -1.073 . . . . 0.0 111.385 174.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 1.055 HD12 HD11 ' A' ' 63' ' ' LEU . 1.9 mm -76.43 -26.82 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.628 0 O-C-N 120.854 -1.154 . . . . 0.0 108.564 -178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.8 HG21 ' HB3' ' A' ' 119' ' ' MET . 54.6 t -58.62 -61.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 54.6 p -56.31 -29.71 61.6 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.395 -0.816 . . . . 0.0 111.706 177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.456 ' HB2' HD23 ' A' ' 63' ' ' LEU . 1.6 t -64.44 -70.58 0.22 Allowed 'General case' 0 N--CA 1.444 -0.729 0 O-C-N 123.839 0.712 . . . . 0.0 109.977 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -155.52 37.78 0.38 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 122.391 1.091 . . . . 0.0 109.833 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.572 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -136.93 33.52 2.31 Favored Glycine 0 N--CA 1.434 -1.472 0 CA-C-O 117.244 -1.865 . . . . 0.0 110.098 -179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.617 HG13 ' HG2' ' A' ' 120' ' ' ARG . 39.2 t -70.76 63.35 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.253 0 CA-C-N 119.435 1.617 . . . . 0.0 110.578 178.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.603 ' HD3' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -96.68 -94.47 0.21 Allowed 'General case' 0 C--O 1.194 -1.823 0 O-C-N 117.728 -3.108 . . . . 0.0 106.972 -171.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.409 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -105.66 -2.89 22.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 124.409 1.084 . . . . 0.0 110.356 175.512 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.8 ' HB3' HG21 ' A' ' 111' ' ' VAL . 1.9 mtt -94.12 10.17 34.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 121.714 -0.616 . . . . 0.0 112.14 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.617 ' HG2' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -158.29 -42.41 0.06 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 118.407 -0.806 . . . . 0.0 110.828 179.412 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.407 ' HB3' ' C ' ' A' ' 125' ' ' ASN . 0.9 OUTLIER -132.51 -165.31 1.58 Allowed 'General case' 0 N--CA 1.441 -0.899 0 O-C-N 125.096 1.498 . . . . 0.0 111.049 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 71.3 p -90.08 -167.08 1.74 Allowed 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 124.13 0.972 . . . . 0.0 110.952 177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.432 ' O ' ' CD ' ' A' ' 78' ' ' GLN . 6.1 mtm180 -39.47 -90.18 0.0 OUTLIER 'General case' 0 C--O 1.196 -1.731 0 CA-C-O 116.64 -1.648 . . . . 0.0 111.199 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.2 t -65.15 82.91 0.05 OUTLIER 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 125.17 1.388 . . . . 0.0 111.118 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.407 ' C ' ' HB3' ' A' ' 121' ' ' GLN . 4.8 m-20 . . . . . 0 CA--C 1.562 1.411 0 CA-C-O 115.515 -2.184 . . . . 0.0 112.595 -171.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.759 0 CA-C-O 117.425 -1.274 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.68 -57.2 0.03 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 O-C-N 125.129 1.518 . . . . 0.0 109.812 178.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -176.5 156.9 1.57 Allowed 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 123.457 0.473 . . . . 0.0 110.164 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.6 ptm -175.92 128.92 0.24 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.132 0.895 . . . . 0.0 110.335 177.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.61 164.64 1.05 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 172.75 109.03 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.534 0.521 . . . . 0.0 109.682 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.4 tttt -167.69 132.58 1.88 Allowed 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.76 -110.37 0.66 Allowed Glycine 0 C--O 1.222 -0.6 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.59 144.18 3.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.912 0.387 . . . . 0.0 110.369 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 172.42 6.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.359 0.599 . . . . 0.0 111.26 177.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.62 29.82 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 122.047 0.927 . . . . 0.0 111.185 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.97 137.2 4.4 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.4 p -176.01 69.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.107 0.48 . . . . 0.0 110.203 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 p -165.29 179.29 6.33 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-O 118.601 -0.714 . . . . 0.0 110.291 179.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 O-C-N 124.879 1.362 . . . . 0.0 110.753 177.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -41.9 -55.41 3.1 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 122.316 -0.24 . . . . 0.0 111.169 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -175.17 40.67 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.332 0 CA-C-O 122.924 1.345 . . . . 0.0 110.322 176.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.446 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -67.9 -34.15 76.1 Favored 'General case' 0 CA--C 1.485 -1.535 0 CA-C-O 113.969 -2.919 . . . . 0.0 108.105 178.645 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.465 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -39.7 -31.7 0.11 Allowed 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 121.496 1.953 . . . . 0.0 112.093 177.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 -74.16 0.18 Allowed 'General case' 0 N--CA 1.433 -1.276 0 C-N-CA 124.504 1.122 . . . . 0.0 111.017 174.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.492 ' HB3' ' CE ' ' A' ' 25' ' ' LYS . 5.0 mt-10 -56.89 -21.48 29.96 Favored 'General case' 0 C--O 1.214 -0.783 0 O-C-N 120.515 -1.366 . . . . 0.0 112.69 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.515 ' CG1' ' CD2' ' A' ' 84' ' ' TYR . 19.5 t -61.22 -47.99 90.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 126.831 2.052 . . . . 0.0 109.03 176.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -77.62 31.11 0.16 Allowed 'General case' 0 C--N 1.325 -0.478 0 O-C-N 121.632 -0.668 . . . . 0.0 112.548 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 -142.32 -47.7 0.35 Allowed 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 123.394 0.678 . . . . 0.0 110.031 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.492 ' CE ' ' HB3' ' A' ' 21' ' ' GLU . 4.8 ptpt -111.63 -51.42 2.86 Favored 'General case' 0 CA--C 1.508 -0.671 0 O-C-N 124.605 1.19 . . . . 0.0 110.607 -179.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.0 OUTLIER -60.06 -175.81 0.04 OUTLIER 'General case' 0 CA--C 1.497 -1.086 0 O-C-N 124.621 1.201 . . . . 0.0 109.195 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.869 HD21 ' HG3' ' A' ' 117' ' ' ARG . 2.2 mm? -39.33 92.84 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 119.537 1.062 . . . . 0.0 113.093 178.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 26' ' ' ASP . 1.6 t -145.45 31.38 1.09 Allowed 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 -168.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -176.66 -32.51 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.439 0 CA-C-O 116.265 -1.826 . . . . 0.0 108.421 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.433 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 25.0 m -61.45 -62.92 1.48 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 121.783 2.083 . . . . 0.0 110.648 178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.557 ' HB2' HD13 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -76.3 -30.93 57.93 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 121.654 0.74 . . . . 0.0 109.673 178.717 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -63.84 -39.14 93.51 Favored 'General case' 0 C--O 1.214 -0.8 0 O-C-N 120.597 -1.314 . . . . 0.0 110.822 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.509 ' CE1' ' HG2' ' A' ' 62' ' ' GLN . 10.4 t80 -52.98 -43.81 66.69 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.677 1.591 . . . . 0.0 110.345 178.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.674 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.95 -27.82 61.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 125.078 1.486 . . . . 0.0 110.428 178.174 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.98 -44.33 80.72 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 123.159 0.584 . . . . 0.0 110.064 177.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.28 -165.56 0.88 Allowed 'General case' 0 N--CA 1.444 -0.749 0 O-C-N 123.572 0.545 . . . . 0.0 110.64 -179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.74 -61.35 1.81 Allowed 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.6 p 160.01 48.5 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.568 1.147 . . . . 0.0 111.071 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 t -85.79 146.16 26.9 Favored 'General case' 0 C--O 1.233 0.227 0 O-C-N 120.727 -1.233 . . . . 0.0 110.523 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -170.34 125.4 0.75 Allowed 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -177.64 131.75 0.16 Allowed 'General case' 0 C--O 1.207 -1.179 0 O-C-N 123.794 0.684 . . . . 0.0 110.247 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' A' ' 46' ' ' GLU . 48.7 p -161.94 102.67 1.15 Allowed 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 119.158 0.89 . . . . 0.0 108.936 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.8 m -144.43 10.75 1.46 Allowed 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.147 -178.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.478 ' N ' HD21 ' A' ' 48' ' ' LEU . . . -133.84 -119.55 2.0 Allowed Glycine 0 C--N 1.338 0.67 0 CA-C-O 122.153 0.863 . . . . 0.0 114.742 172.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -86.72 23.72 1.62 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.444 1.116 . . . . 0.0 111.245 178.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.67 ' OE1' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -79.26 -153.87 0.08 Allowed 'General case' 0 N--CA 1.442 -0.845 0 O-C-N 120.583 -1.323 . . . . 0.0 110.681 -179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.67 HG12 ' OE1' ' A' ' 46' ' ' GLU . 2.5 p -74.64 49.92 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-O 123.981 1.848 . . . . 0.0 110.933 175.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.649 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.7 OUTLIER -129.44 30.13 4.99 Favored 'General case' 0 C--N 1.318 -0.786 0 O-C-N 119.041 -2.287 . . . . 0.0 109.408 178.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.5 27.09 7.14 Favored 'General case' 0 CA--C 1.508 -0.647 0 O-C-N 120.187 -1.571 . . . . 0.0 112.349 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.439 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.0 OUTLIER 168.19 -54.9 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.377 0 C-N-CA 124.079 0.952 . . . . 0.0 111.132 -173.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 19.6 Cg_endo -74.93 81.18 2.25 Favored 'Trans proline' 0 N--CA 1.449 -1.139 0 C-N-CA 122.871 2.381 . . . . 0.0 111.12 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -178.92 84.69 0.07 OUTLIER Glycine 0 C--O 1.223 -0.591 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.282 -178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.3 -63.48 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 O-C-N 125.164 1.155 . . . . 0.0 109.27 178.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -104.11 76.34 1.34 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 -177.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.421 ' ND2' HE22 ' A' ' 64' ' ' GLN . 2.9 p-10 -130.4 135.56 48.14 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.578 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -85.82 146.53 26.71 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 121.816 -0.553 . . . . 0.0 111.025 176.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -126.17 112.93 16.36 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.921 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -118.37 -79.54 0.6 Allowed 'General case' 0 CA--C 1.515 -0.393 0 O-C-N 123.487 0.492 . . . . 0.0 109.807 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.85 40.66 0.33 Allowed 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.659 0.742 . . . . 0.0 110.675 -178.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.7 m -170.2 86.01 0.12 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 122.083 0.944 . . . . 0.0 108.951 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -66.62 -19.91 65.88 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.549 -0.719 . . . . 0.0 110.9 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.509 ' HG2' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -71.89 -39.1 69.81 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.901 -1.125 . . . . 0.0 110.489 179.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.742 HD11 ' CD1' ' A' ' 110' ' ' ILE . 6.3 mp -69.82 -28.12 65.44 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.421 HE22 ' ND2' ' A' ' 55' ' ' ASN . 9.2 tt0 -55.93 -32.07 63.49 Favored 'General case' 0 N--CA 1.451 -0.421 0 O-C-N 121.997 -0.439 . . . . 0.0 110.655 175.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.08 -31.48 67.88 Favored 'General case' 0 C--O 1.205 -1.278 0 CA-C-O 118.017 -0.992 . . . . 0.0 109.695 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.676 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.9 t -73.62 -47.4 40.42 Favored 'General case' 0 C--O 1.21 -1.014 0 CA-C-N 119.784 1.174 . . . . 0.0 109.11 177.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 t -59.16 -51.1 71.46 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 120.455 1.479 . . . . 0.0 110.055 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -59.61 -25.83 64.96 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 123.347 0.404 . . . . 0.0 112.022 174.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -77.87 -47.74 18.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 123.557 0.743 . . . . 0.0 111.065 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 66' ' ' CYS . 13.2 t -71.63 -16.82 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 O-C-N 119.96 -1.713 . . . . 0.0 109.406 178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -74.65 -23.53 58.68 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.664 -0.648 . . . . 0.0 110.144 175.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -96.27 10.12 38.93 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.369 176.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.84 HG23 ' HA ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.69 142.81 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.626 0 CA-C-N 120.064 1.302 . . . . 0.0 109.639 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.1 mtt180 -38.94 -67.06 0.23 Allowed 'General case' 0 CA--C 1.492 -1.251 0 CA-C-O 116.334 -1.793 . . . . 0.0 110.4 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 164.03 -33.95 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.243 0 O-C-N 127.994 3.308 . . . . 0.0 108.727 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -136.36 7.87 3.11 Favored 'General case' 0 C--N 1.35 0.592 0 C-N-CA 126.474 1.91 . . . . 0.0 111.205 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.2 m -100.8 -4.68 27.51 Favored 'General case' 0 N--CA 1.44 -0.955 0 O-C-N 120.916 -1.115 . . . . 0.0 109.363 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.684 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.31 -37.24 86.48 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 118.901 0.773 . . . . 0.0 109.504 179.049 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -62.07 1.63 Allowed 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.169 -1.582 . . . . 0.0 109.436 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -51.68 -25.96 8.29 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.37 0.532 . . . . 0.0 111.328 177.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.564 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -64.31 -39.21 93.45 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 123.993 0.917 . . . . 0.0 111.873 174.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.619 HD13 ' HG ' ' A' ' 27' ' ' LEU . 3.8 mm -61.91 -50.81 78.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 C-N-CA 125.638 1.575 . . . . 0.0 109.046 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.59 -9.18 40.51 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 119.553 -1.967 . . . . 0.0 111.015 176.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.515 ' CD2' ' CG1' ' A' ' 22' ' ' VAL . 49.4 t80 -100.27 13.18 35.18 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.258 1.823 . . . . 0.0 112.52 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.7 tt -155.35 -56.57 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.203 -1.376 0 O-C-N 119.749 -1.844 . . . . 0.0 109.033 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 85' ' ' ILE . . . -60.2 -62.33 1.95 Allowed 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.972 1.709 . . . . 0.0 107.964 176.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -71.84 -37.19 70.32 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.066 -1.022 . . . . 0.0 110.123 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -57.81 -58.07 9.99 Favored 'General case' 0 CA--C 1.501 -0.939 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.593 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.9 pt20 -61.01 -36.74 80.3 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-O 115.379 -2.248 . . . . 0.0 108.328 178.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.598 ' CG1' HG11 ' A' ' 103' ' ' VAL . 20.8 mt -61.96 -41.69 91.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 121.271 1.851 . . . . 0.0 108.759 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -76.87 -43.12 37.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 O-C-N 121.793 -0.567 . . . . 0.0 112.025 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.91 -62.43 1.41 Allowed 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.685 1.194 . . . . 0.0 110.381 -179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.497 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -57.35 177.96 1.07 Allowed Glycine 0 N--CA 1.439 -1.131 0 CA-C-O 123.554 1.641 . . . . 0.0 112.281 175.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -85.42 42.61 0.96 Allowed 'General case' 0 C--O 1.202 -1.395 0 O-C-N 120.834 -1.392 . . . . 0.0 110.24 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.868 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -90.97 12.63 19.04 Favored 'General case' 0 C--N 1.314 -0.945 0 O-C-N 118.834 -2.416 . . . . 0.0 108.11 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 3.1 m170 -92.77 -177.21 4.47 Favored 'General case' 0 C--O 1.215 -0.736 0 O-C-N 120.042 -1.661 . . . . 0.0 111.257 177.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 76.26 -72.15 1.93 Allowed Glycine 0 C--O 1.222 -0.621 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -166.13 54.38 0.1 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 124.15 1.928 . . . . 0.0 111.066 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -158.67 23.73 0.22 Allowed 'General case' 0 C--N 1.322 -0.598 0 O-C-N 119.613 -1.929 . . . . 0.0 109.49 -175.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.79 -34.73 16.06 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.65 178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.14 -32.19 63.06 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.422 1.106 . . . . 0.0 108.75 -177.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.403 HH21 ' CD1' ' A' ' 95' ' ' LEU . 14.0 ptt180 -62.19 -26.86 68.58 Favored 'General case' 0 C--O 1.214 -0.781 0 O-C-N 120.209 -1.557 . . . . 0.0 109.977 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.868 HG21 ' HG ' ' A' ' 95' ' ' LEU . 4.3 t -79.51 -28.22 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 C-N-CA 123.522 0.729 . . . . 0.0 109.422 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.17 83.44 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.975 177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -66.92 -45.9 76.48 Favored 'General case' 0 C--O 1.206 -1.212 0 CA-C-O 118.005 -0.998 . . . . 0.0 108.914 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.674 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -58.79 -46.94 86.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 119.302 0.956 . . . . 0.0 111.518 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.497 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.73 -61.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.72 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -44.52 -32.68 2.91 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 125.944 1.735 . . . . 0.0 112.442 173.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.06 -51.56 67.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 123.076 1.417 . . . . 0.0 110.768 176.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.742 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -74.86 -27.72 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.673 0 O-C-N 119.986 -1.696 . . . . 0.0 110.097 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.688 HG21 ' CB ' ' A' ' 119' ' ' MET . 85.9 t -57.77 -53.71 41.36 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 O-C-N 122.184 -0.322 . . . . 0.0 110.321 176.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 57.3 p -58.35 -24.76 60.76 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 123.85 0.719 . . . . 0.0 111.771 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -77.12 -77.36 0.15 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 121.389 0.614 . . . . 0.0 110.837 178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.587 ' O ' HG21 ' A' ' 70' ' ' VAL . 1.8 t -146.66 47.01 1.19 Allowed 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -141.58 21.72 2.54 Favored Glycine 0 C--O 1.22 -0.78 0 O-C-N 120.152 -1.592 . . . . 0.0 109.914 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.657 HG23 ' HB3' ' A' ' 120' ' ' ARG . 1.9 p -70.61 62.43 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.346 0 C-N-CA 125.982 1.713 . . . . 0.0 109.932 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.869 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.8 mmp_? -96.89 -71.09 0.69 Allowed 'General case' 0 CA--C 1.494 -1.199 0 O-C-N 120.923 -1.11 . . . . 0.0 109.342 -175.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -122.51 -1.52 9.06 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 123.893 0.877 . . . . 0.0 110.623 175.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.688 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 -4.67 37.7 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 121.278 0.561 . . . . 0.0 112.106 177.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.657 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -156.42 20.8 0.35 Allowed 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 123.247 0.619 . . . . 0.0 111.37 177.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.11 -154.82 0.48 Allowed 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 -177.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.487 HG22 ' H ' ' A' ' 123' ' ' ARG . 9.2 m -153.26 174.86 13.74 Favored 'General case' 0 CA--C 1.504 -0.827 0 O-C-N 125.057 1.473 . . . . 0.0 110.317 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.487 ' H ' HG22 ' A' ' 122' ' ' THR . 1.4 ttt180 -52.39 92.98 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.557 1.143 . . . . 0.0 111.369 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.442 HG23 ' O ' ' A' ' 122' ' ' THR . 54.3 p -77.11 -60.23 2.45 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 115.952 -1.975 . . . . 0.0 106.574 -173.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.1 m120 . . . . . 0 C--O 1.298 3.623 0 C-N-CA 127.289 2.236 . . . . 0.0 111.888 -173.802 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.3 71.92 0.6 Allowed 'General case' 0 C--O 1.22 -0.466 0 O-C-N 124.544 1.153 . . . . 0.0 109.918 -179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -57.92 98.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.106 -0.996 . . . . 0.0 111.686 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -161.66 101.18 1.17 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.724 0.773 . . . . 0.0 109.738 -175.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -136.19 146.12 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 171.33 164.92 0.09 Allowed 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 124.975 1.31 . . . . 0.0 110.109 177.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.48 98.64 2.67 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.777 -0.577 . . . . 0.0 110.02 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.3 90.55 0.1 OUTLIER Glycine 0 C--O 1.222 -0.631 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -141.97 -66.16 0.41 Allowed 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 122.413 0.285 . . . . 0.0 111.515 178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 -76.76 -69.53 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.055 0.542 . . . . 0.0 111.444 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.81 132.67 34.39 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.843 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.7 -41.3 19.95 Favored Glycine 0 CA--C 1.523 0.569 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.083 178.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 176.52 -34.53 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 125.54 1.536 . . . . 0.0 112.028 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.4 p -163.44 147.85 10.83 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.938 1.295 . . . . 0.0 108.846 178.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.3 t -58.99 -165.48 0.01 OUTLIER 'General case' 0 C--N 1.34 0.155 0 O-C-N 125.048 1.468 . . . . 0.0 111.266 174.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -37.63 -53.4 1.22 Allowed 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.333 -0.855 . . . . 0.0 113.047 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -172.44 45.06 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.27 1.028 . . . . 0.0 110.632 174.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -41.11 71.16 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-O 115.776 -2.059 . . . . 0.0 109.482 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 1.6 ttt85 -47.99 -32.67 6.83 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.563 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -54.36 37.24 Favored 'General case' 0 N--CA 1.426 -1.669 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 171.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.84 -36.24 62.38 Favored 'General case' 0 C--O 1.204 -1.321 0 O-C-N 120.34 -1.475 . . . . 0.0 113.292 173.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.836 HG13 ' HB2' ' A' ' 26' ' ' ASP . 63.1 t -56.81 -33.54 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.119 0 C-N-CA 127.615 2.366 . . . . 0.0 110.432 175.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -6.54 17.95 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 174.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -143.08 15.28 1.89 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 128.097 2.559 . . . . 0.0 113.106 -176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -148.09 -86.96 0.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.027 0.931 . . . . 0.0 110.403 -173.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.836 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -60.35 166.46 3.01 Favored 'General case' 0 N--CA 1.423 -1.793 0 CA-C-O 117.217 -1.373 . . . . 0.0 109.296 177.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.2 mm? -0.55 77.34 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.539 2.336 . . . . 0.0 113.771 177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.6 t -135.69 29.07 3.24 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 124.754 2.216 . . . . 0.0 108.093 -167.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.8 t -172.53 -31.54 0.01 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 O-C-N 120.329 -1.482 . . . . 0.0 111.944 -177.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 21.7 m -54.82 -50.68 68.0 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 176.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -76.8 -28.9 55.78 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 122.5 1.143 . . . . 0.0 111.508 175.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -63.21 -32.74 74.21 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.249 -1.532 . . . . 0.0 112.429 175.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.3 t80 -58.07 -46.97 84.55 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 126.281 1.832 . . . . 0.0 110.096 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.651 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -73.26 -24.66 60.48 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 124.267 0.979 . . . . 0.0 112.132 176.118 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -67.69 -40.25 84.36 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 122.912 0.485 . . . . 0.0 110.669 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -164.96 0.54 Allowed 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 123.943 0.777 . . . . 0.0 111.821 178.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 37.3 t -145.0 -44.4 0.23 Allowed 'General case' 0 N--CA 1.444 -0.731 0 C-N-CA 123.495 0.718 . . . . 0.0 111.47 175.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.98 106.65 1.61 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 121.68 0.752 . . . . 0.0 110.157 -178.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 p -166.39 167.74 15.55 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.719 0.771 . . . . 0.0 109.809 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.12 -68.94 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.563 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.66 -175.57 0.53 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.565 1.946 . . . . 0.0 111.566 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.01 -155.03 0.11 Allowed 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 124.763 1.289 . . . . 0.0 111.092 175.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 66.1 p -70.23 107.93 3.94 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 125.561 1.545 . . . . 0.0 111.717 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 94.88 118.19 3.11 Favored Glycine 0 C--O 1.224 -0.507 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -176.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -156.98 68.98 0.57 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 122.55 1.167 . . . . 0.0 111.142 178.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.56 86.96 3.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 122.179 0.99 . . . . 0.0 110.384 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 8.6 t -83.14 47.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 122.33 1.062 . . . . 0.0 109.771 -176.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.86 21.9 0.27 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.584 1.154 . . . . 0.0 111.658 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.74 22.28 0.27 Allowed 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 171.9 -55.68 0.0 OUTLIER Pre-proline 0 N--CA 1.446 -0.628 0 C-N-CA 125.852 1.661 . . . . 0.0 111.799 -170.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -73.62 -91.78 0.01 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.332 0 C-N-CA 123.46 2.774 . . . . 0.0 107.607 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.49 -57.48 0.19 Allowed Glycine 0 C--O 1.214 -1.143 0 CA-C-O 117.555 -1.691 . . . . 0.0 113.483 -174.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -56.34 -41.35 75.94 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 126.026 1.73 . . . . 0.0 112.757 175.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -48.8 156.28 0.5 Allowed 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 123.448 0.699 . . . . 0.0 111.6 175.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 56.59 93.1 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 121.694 0.759 . . . . 0.0 110.158 -168.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.42 162.19 0.16 Allowed 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.938 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -40.24 111.18 0.18 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.731 0.777 . . . . 0.0 112.759 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -158.17 150.6 22.18 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 122.006 0.908 . . . . 0.0 109.799 -177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.52 68.91 2.99 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 111.444 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.2 t -171.48 97.78 0.19 Allowed 'General case' 0 N--CA 1.449 -0.515 0 O-C-N 120.083 -1.636 . . . . 0.0 109.276 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -63.84 -25.49 68.19 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.479 0.657 . . . . 0.0 112.082 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.462 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 4.2 mt-30 -80.2 -47.9 13.95 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.473 -0.767 . . . . 0.0 111.992 -178.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -57.64 -28.95 64.18 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 113.24 0.829 . . . . 0.0 113.24 171.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -57.27 -36.87 71.54 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.637 170.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -41.0 97.69 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 117.63 -1.176 . . . . 0.0 110.991 176.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.472 ' O ' HG23 ' A' ' 70' ' ' VAL . 13.5 t -70.25 -47.83 59.57 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 119.382 0.992 . . . . 0.0 110.745 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.08 -39.52 82.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.721 1.146 . . . . 0.0 111.378 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.15 -29.87 65.76 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 125.503 1.521 . . . . 0.0 111.401 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -78.32 -51.62 9.84 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 124.49 1.116 . . . . 0.0 111.54 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.881 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 26.1 t -58.87 -23.31 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 O-C-N 121.222 -0.924 . . . . 0.0 111.268 172.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -16.07 63.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 172.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -93.66 0.08 56.31 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 126.052 1.741 . . . . 0.0 111.533 174.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.799 HG11 ' HG3' ' A' ' 78' ' ' GLN . 43.5 t -63.19 142.7 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-N 119.15 0.886 . . . . 0.0 110.133 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.7 mmt85 -55.05 -72.78 0.06 Allowed 'General case' 0 C--O 1.207 -1.179 0 CA-C-O 114.041 -2.885 . . . . 0.0 110.962 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 175.98 -84.64 0.0 OUTLIER 'General case' 0 C--O 1.237 0.417 0 O-C-N 128.985 3.928 . . . . 0.0 108.703 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.517 ' HA ' HG22 ' A' ' 124' ' ' THR . 2.2 pt-20 -77.34 -3.08 38.22 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.155 1.382 . . . . 0.0 113.527 178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 74.9 m -82.96 -3.58 57.29 Favored 'General case' 0 N--CA 1.424 -1.775 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.056 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.799 ' HG3' HG11 ' A' ' 73' ' ' VAL . 39.0 mt-30 -53.14 -66.26 0.42 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.824 1.25 . . . . 0.0 110.888 176.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.23 -56.17 25.51 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 116.767 -1.587 . . . . 0.0 111.4 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -40.31 -37.07 0.61 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 111.886 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.81 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -63.58 -54.9 28.7 Favored 'General case' 0 N--CA 1.421 -1.894 0 CA-C-O 118.464 -0.779 . . . . 0.0 112.413 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 49.8 mm -55.62 -32.12 30.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 119.41 1.005 . . . . 0.0 110.893 171.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.51 -14.37 62.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 120.851 -1.156 . . . . 0.0 113.217 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.439 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 84.3 t80 -106.27 -70.89 0.77 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 129.152 2.981 . . . . 0.0 109.134 -177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 85' ' ' ILE . 8.3 tp -57.89 -51.17 73.82 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.08 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.367 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -78.7 46.47 0.66 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 126.667 1.987 . . . . 0.0 111.187 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -170.1 -46.9 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 125.368 1.467 . . . . 0.0 112.246 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.06 -51.79 68.23 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.368 1.067 . . . . 0.0 108.353 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD13 ' A' ' 90' ' ' ILE . 3.8 pt20 -59.82 -21.63 61.13 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.14 -0.975 . . . . 0.0 113.382 175.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.477 ' CD1' HG11 ' A' ' 103' ' ' VAL . 15.8 mm -75.63 -46.09 37.38 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 C-N-CA 125.226 1.41 . . . . 0.0 109.76 178.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -73.77 -37.43 65.01 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 174.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.51 -55.81 5.32 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 125.999 1.72 . . . . 0.0 111.819 -178.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.13 179.03 4.59 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-O 122.327 0.959 . . . . 0.0 112.615 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.96 27.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 100' ' ' SER . 1.8 mm? -92.98 89.32 6.48 Favored 'General case' 0 N--CA 1.436 -1.143 0 O-C-N 119.914 -1.741 . . . . 0.0 110.999 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -150.57 167.84 26.03 Favored 'General case' 0 C--O 1.218 -0.566 0 O-C-N 121.935 -0.478 . . . . 0.0 110.829 -175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.43 -80.0 1.69 Allowed Glycine 0 C--O 1.221 -0.692 0 CA-C-O 118.879 -0.956 . . . . 0.0 111.062 -177.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -163.08 33.59 0.1 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 124.516 2.103 . . . . 0.0 111.156 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -121.05 -3.76 9.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 O-C-N 119.847 -1.783 . . . . 0.0 109.652 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.62 ' HA ' HD12 ' A' ' 95' ' ' LEU . 12.1 p -72.96 -26.95 61.55 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 118.949 -2.344 . . . . 0.0 113.503 176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.52 -28.7 64.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.144 0.973 . . . . 0.0 111.14 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 9.2 ptt180 -66.37 -25.15 66.66 Favored 'General case' 0 C--O 1.22 -0.493 0 O-C-N 121.311 -0.868 . . . . 0.0 111.724 175.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.566 ' CG2' HD11 ' A' ' 95' ' ' LEU . 2.4 t -82.61 -28.81 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.144 0.578 . . . . 0.0 109.733 178.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.95 -42.33 90.14 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-O 122.271 1.034 . . . . 0.0 111.125 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -63.2 -38.23 90.34 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 120.494 -1.379 . . . . 0.0 112.542 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.651 ' CB ' HD13 ' A' ' 34' ' ' LEU . 3.9 mpp_? -63.42 -30.29 71.44 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.152 177.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.549 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -69.02 -48.94 61.72 Favored 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 122.969 0.508 . . . . 0.0 110.08 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.26 -35.17 4.9 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 124.995 1.284 . . . . 0.0 113.814 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.15 -57.29 9.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.719 0.759 . . . . 0.0 112.846 171.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.533 HD12 HD21 ' A' ' 63' ' ' LEU . 3.0 mm -69.48 -28.96 40.0 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.761 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.33 178.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.751 HG21 ' CB ' ' A' ' 119' ' ' MET . 95.8 t -60.45 -59.51 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.658 177.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 41.3 t -55.13 -26.51 38.94 Favored 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.442 1.088 . . . . 0.0 112.485 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.39 -77.62 0.1 Allowed 'General case' 0 N--CA 1.446 -0.637 0 O-C-N 124.033 0.833 . . . . 0.0 111.68 175.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.7 t -148.59 30.27 0.83 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.054 0.942 . . . . 0.0 111.772 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.47 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -125.2 26.61 5.51 Favored Glycine 0 C--O 1.219 -0.798 0 C-N-CA 125.304 1.43 . . . . 0.0 111.334 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.612 ' HA ' HG13 ' A' ' 111' ' ' VAL . 7.4 p -69.43 100.66 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 C-N-CA 127.191 2.196 . . . . 0.0 114.367 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.881 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -142.3 -73.34 0.31 Allowed 'General case' 0 C--O 1.21 -1.024 0 O-C-N 121.779 -0.575 . . . . 0.0 110.469 -171.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.14 0.1 8.41 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 124.194 0.998 . . . . 0.0 111.834 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.751 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -96.68 0.63 50.02 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.66 0.784 . . . . 0.0 112.372 176.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 4.5 ttm180 -157.37 -94.96 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 124.665 1.186 . . . . 0.0 110.503 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.501 ' H ' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -108.41 122.56 47.27 Favored 'General case' 0 N--CA 1.435 -1.2 0 C-N-CA 125.712 1.605 . . . . 0.0 108.39 -174.242 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 13.3 p -93.88 143.54 26.25 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.968 -176.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.11 173.24 2.24 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.517 HG22 ' HA ' ' A' ' 76' ' ' GLU . 15.8 p -145.77 107.51 4.29 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 104.019 -2.586 . . . . 0.0 104.019 -175.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . 0.316 1.0 OUTLIER . . . . . 0 C--O 1.276 2.469 0 CA-C-O 115.313 -2.28 . . . . 0.0 116.565 172.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -161.27 116.96 2.14 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 107.506 -1.294 . . . . 0.0 107.506 -176.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -74.97 142.97 43.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.602 177.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.36 55.42 0.46 Allowed 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 174.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -143.3 150.09 38.74 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 124.602 1.161 . . . . 0.0 108.86 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 168.01 113.51 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.563 1.545 . . . . 0.0 109.551 -177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.57 113.18 0.27 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.773 1.229 . . . . 0.0 109.283 177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.39 -110.88 0.49 Allowed Glycine 0 C--O 1.226 -0.401 0 N-CA-C 108.879 -1.688 . . . . 0.0 108.879 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -162.14 -55.77 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.504 0.669 . . . . 0.0 111.613 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.57 175.63 11.23 Favored 'General case' 0 C--O 1.219 -0.546 0 C-N-CA 125.025 1.33 . . . . 0.0 110.599 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.91 111.27 6.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.789 1.235 . . . . 0.0 110.027 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.21 41.2 0.02 OUTLIER Glycine 0 N--CA 1.468 0.808 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.97 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 t -142.72 80.0 1.68 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 p -54.94 162.11 1.39 Allowed 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.728 0.775 . . . . 0.0 111.344 172.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -178.14 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.587 172.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -35.19 -51.38 0.56 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -168.67 38.42 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.598 1.159 . . . . 0.0 110.653 171.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -61.01 -57.35 12.97 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-O 117.21 -1.376 . . . . 0.0 109.232 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -33.38 -41.94 0.09 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.674 1.99 . . . . 0.0 114.344 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.35 -70.9 0.08 Allowed 'General case' 0 C--O 1.213 -0.842 0 O-C-N 125.066 1.478 . . . . 0.0 113.212 171.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -75.97 -23.88 55.35 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.178 1.391 . . . . 0.0 113.497 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -51.69 -65.38 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 CA-C-O 113.769 -3.015 . . . . 0.0 106.697 167.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -64.6 34.69 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 117.969 2.581 . . . . 0.0 117.969 -171.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 63.5 mtt180 -146.28 -54.44 0.26 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 129.056 2.942 . . . . 0.0 108.918 -164.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.8 pttt -119.66 -16.99 8.74 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 127.669 2.388 . . . . 0.0 114.817 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.708 ' HA ' HG23 ' A' ' 73' ' ' VAL . 1.6 p-10 -53.15 -154.46 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 125.103 2.382 . . . . 0.0 115.81 165.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -74.41 55.06 0.61 Allowed 'General case' 0 N--CA 1.442 -0.86 0 O-C-N 120.076 -1.64 . . . . 0.0 110.913 172.792 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t -98.93 17.8 18.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.424 2.29 . . . . 0.0 111.581 176.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.22 -41.8 0.16 Allowed 'General case' 0 C--O 1.21 -1.01 0 C-N-CA 124.822 1.249 . . . . 0.0 112.456 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 9.9 m -57.16 -58.66 7.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 119.352 0.978 . . . . 0.0 113.075 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -75.81 -30.82 59.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 119.422 -0.911 . . . . 0.0 112.339 175.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 -62.19 -30.83 71.34 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 120.729 -1.232 . . . . 0.0 113.176 176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -57.51 -49.16 77.24 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 128.095 2.558 . . . . 0.0 110.031 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.3 OUTLIER -69.92 -26.86 64.35 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 175.586 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -69.82 -40.29 75.98 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.957 0.903 . . . . 0.0 111.527 177.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.03 -164.67 0.64 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.642 1.177 . . . . 0.0 110.355 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -146.32 -45.11 0.19 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 125.556 1.542 . . . . 0.0 110.857 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -163.64 107.91 1.02 Allowed 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.747 -0.596 . . . . 0.0 109.55 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.9 t -150.5 175.29 12.02 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 124.217 1.007 . . . . 0.0 108.695 177.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.23 129.29 5.68 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 174.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 -43.29 133.96 3.93 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.086 0.954 . . . . 0.0 109.382 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.42 -165.3 0.14 Allowed 'General case' 0 C--O 1.237 0.434 0 O-C-N 126.036 2.085 . . . . 0.0 109.331 174.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 48.7 p -53.97 94.36 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.235 2.214 . . . . 0.0 111.276 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 176.2 -115.55 0.53 Allowed Glycine 0 C--O 1.222 -0.647 0 O-C-N 121.017 -1.052 . . . . 0.0 110.82 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -82.19 28.61 0.44 Allowed 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 119.067 -0.492 . . . . 0.0 111.554 176.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.593 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.7 tt0 -37.77 94.92 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.617 1.567 . . . . 0.0 112.735 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.9 t -83.77 49.38 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 123.077 1.418 . . . . 0.0 108.032 -172.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.593 HD23 ' HG2' ' A' ' 46' ' ' GLU . 0.3 OUTLIER -105.51 -23.17 12.85 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.119 1.768 . . . . 0.0 110.017 178.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.45 25.77 8.14 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 125.529 1.531 . . . . 0.0 112.861 -177.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.3 mmt -109.78 86.83 5.01 Favored Pre-proline 0 C--N 1.327 -0.413 0 C-N-CA 124.915 1.286 . . . . 0.0 109.106 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -70.69 132.64 22.21 Favored 'Trans proline' 0 N--CA 1.446 -1.311 0 C-N-CA 122.748 2.299 . . . . 0.0 108.19 177.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -132.69 90.09 0.27 Allowed Glycine 0 C--O 1.218 -0.848 0 N-CA-C 107.709 -2.156 . . . . 0.0 107.709 176.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -49.97 -31.65 13.09 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.89 1.345 . . . . 0.0 113.152 173.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.94 34.2 0.29 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 127.148 2.179 . . . . 0.0 113.411 174.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.472 ' OD1' ' HB3' ' A' ' 67' ' ' CYS . 27.0 m-20 -170.41 159.08 6.84 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 126.658 1.983 . . . . 0.0 109.639 178.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.2 95.27 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 176.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 tm0? -119.09 62.82 0.79 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 -173.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -151.74 -67.13 0.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.027 177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -141.38 41.29 1.76 Allowed 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 124.233 1.968 . . . . 0.0 111.192 -177.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -169.19 37.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.508 -1.37 . . . . 0.0 111.395 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -57.34 -14.57 4.76 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 121.946 0.879 . . . . 0.0 112.955 175.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -67.97 -58.19 4.95 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.775 HD11 HD12 ' A' ' 110' ' ' ILE . 6.8 mp -62.88 -27.07 69.1 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 121.613 -0.679 . . . . 0.0 112.697 175.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -54.38 -36.91 64.39 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 119.394 -0.336 . . . . 0.0 111.401 168.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -63.28 -40.93 98.75 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 117.708 -1.139 . . . . 0.0 110.953 175.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.8 t -65.73 -47.53 74.99 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 124.414 1.085 . . . . 0.0 112.284 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.472 ' HB3' ' OD1' ' A' ' 55' ' ' ASN . 1.3 t -62.67 -49.54 74.71 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 117.536 -1.221 . . . . 0.0 111.39 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -53.33 -43.55 67.75 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 120.54 1.518 . . . . 0.0 111.463 169.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -59.75 -52.26 66.24 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.982 1.372 . . . . 0.0 109.291 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.582 HG11 ' NE ' ' A' ' 117' ' ' ARG . 76.4 t -64.4 -33.23 61.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 118.545 -2.597 . . . . 0.0 110.735 177.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.3 -23.97 66.47 Favored 'General case' 0 C--N 1.321 -0.659 0 O-C-N 120.511 -1.368 . . . . 0.0 113.059 178.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -92.27 0.32 57.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.94 1.296 . . . . 0.0 112.919 171.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.708 HG23 ' HA ' ' A' ' 26' ' ' ASP . 4.7 p -58.87 176.0 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-N 119.177 0.899 . . . . 0.0 110.301 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.551 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.4 OUTLIER -45.91 -75.78 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 116.352 -1.785 . . . . 0.0 113.66 173.332 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 165.05 -45.49 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 O-C-N 128.102 3.376 . . . . 0.0 108.587 -175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -136.93 7.98 2.97 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.184 -2.198 . . . . 0.0 114.225 -169.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 49.7 m -112.04 -3.48 14.75 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.819 1.248 . . . . 0.0 112.893 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.545 ' HB3' HG21 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -52.2 -26.7 12.29 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.375 1.07 . . . . 0.0 113.04 167.621 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.615 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -73.54 -64.52 0.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 O-C-N 120.393 -1.442 . . . . 0.0 110.326 -177.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -55.8 -31.62 62.82 Favored 'General case' 0 C--O 1.22 -0.473 0 O-C-N 121.57 -0.707 . . . . 0.0 112.842 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.57 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -51.8 -41.33 61.63 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 170.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.408 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 17.3 mm -58.86 -49.76 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 123.72 0.808 . . . . 0.0 112.304 169.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -65.68 -7.23 14.27 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -102.35 9.82 39.54 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 129.255 3.022 . . . . 0.0 112.061 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 81' ' ' ALA . 1.0 OUTLIER -152.19 -56.77 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 O-C-N 120.812 -1.18 . . . . 0.0 113.063 -178.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.452 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.86 -67.61 0.32 Allowed 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 124.61 1.164 . . . . 0.0 109.064 172.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.86 -31.6 69.53 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 178.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.42 -59.6 5.0 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.623 0.769 . . . . 0.0 110.668 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.61 ' O ' HD23 ' A' ' 95' ' ' LEU . 1.5 pt20 -55.58 -37.81 68.54 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 116.231 -1.843 . . . . 0.0 110.305 174.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.4 mt -57.31 -46.68 85.27 Favored 'Isoleucine or valine' 0 C--N 1.347 0.467 0 CA-C-N 119.567 1.076 . . . . 0.0 110.84 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -71.72 -47.22 55.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -57.57 8.54 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 125.493 1.517 . . . . 0.0 112.832 -176.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.412 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.76 172.42 19.71 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 125.935 1.731 . . . . 0.0 111.462 172.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -76.63 37.26 0.17 Allowed 'General case' 0 C--O 1.205 -1.276 0 O-C-N 121.055 -1.262 . . . . 0.0 112.612 178.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.782 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -87.68 16.94 5.07 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 119.359 -2.088 . . . . 0.0 108.586 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -93.58 -178.93 4.86 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 118.46 -2.65 . . . . 0.0 111.624 176.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.97 -67.92 3.66 Favored Glycine 0 CA--C 1.526 0.739 0 CA-C-O 117.843 -1.532 . . . . 0.0 110.39 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -169.12 35.93 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 124.832 2.253 . . . . 0.0 112.931 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -139.34 20.75 2.58 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 118.966 -2.334 . . . . 0.0 111.271 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.9 -42.85 11.59 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.582 1.553 . . . . 0.0 109.231 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.91 -32.46 70.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.389 178.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.08 -31.27 72.37 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.26 -0.9 . . . . 0.0 112.171 174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.782 HG21 ' HG ' ' A' ' 95' ' ' LEU . 39.6 t -78.83 -32.46 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 124.14 0.976 . . . . 0.0 111.041 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.47 -39.73 84.62 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.32 0.387 . . . . 0.0 111.486 172.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -61.88 -52.66 63.21 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.88 174.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.58 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -52.37 -46.4 66.16 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.935 0.772 . . . . 0.0 112.827 -178.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -62.92 -55.55 25.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.237 176.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -38.32 -33.02 0.16 Allowed Glycine 0 CA--C 1.532 1.139 0 C-N-CA 127.514 2.483 . . . . 0.0 114.583 173.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -55.0 -61.93 1.99 Allowed 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.035 1.398 . . . . 0.0 111.81 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.775 HD12 HD11 ' A' ' 63' ' ' LEU . 2.6 mm -70.52 -25.43 26.79 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.866 0 O-C-N 121.332 -0.855 . . . . 0.0 110.601 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.629 HG21 ' CB ' ' A' ' 119' ' ' MET . 93.5 t -60.5 -67.73 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.64 -0.695 . . . . 0.0 109.816 175.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -51.94 -26.72 11.05 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 174.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.596 ' OG ' HD23 ' A' ' 63' ' ' LEU . 30.7 t -70.87 -76.29 0.11 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.654 0.661 . . . . 0.0 112.69 172.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.482 ' C ' HH21 ' A' ' 117' ' ' ARG . 1.0 OUTLIER -145.84 30.05 1.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.286 1.835 . . . . 0.0 112.984 -176.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -133.38 24.07 3.77 Favored Glycine 0 CA--C 1.533 1.195 0 C-N-CA 126.237 1.875 . . . . 0.0 111.379 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 111' ' ' VAL . 54.5 t -68.3 64.83 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 127.918 2.487 . . . . 0.0 110.614 177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.582 ' NE ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -100.7 -73.95 0.63 Allowed 'General case' 0 C--O 1.207 -1.156 0 O-C-N 120.979 -1.075 . . . . 0.0 109.798 -172.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.452 ' SG ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -129.76 2.52 4.92 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 125.185 1.394 . . . . 0.0 112.698 173.335 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.629 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -94.54 2.91 55.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.379 1.072 . . . . 0.0 112.081 178.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.532 ' HD3' HG13 ' A' ' 116' ' ' VAL . 1.5 tmt_? -151.57 -63.47 0.18 Allowed 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 124.574 1.149 . . . . 0.0 111.112 178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -147.5 123.76 10.89 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 124.76 1.224 . . . . 0.0 111.234 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.615 HG22 ' SG ' ' A' ' 79' ' ' CYS . 48.2 p -79.9 130.78 35.58 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.681 1.993 . . . . 0.0 109.287 -177.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm180 -141.82 52.01 1.51 Allowed 'General case' 0 C--O 1.219 -0.503 0 O-C-N 121.261 -0.9 . . . . 0.0 109.907 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 59.4 p -58.89 82.08 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.185 1.394 . . . . 0.0 110.397 177.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 116.306 -1.807 . . . . 0.0 112.113 -179.121 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.28 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -159.5 -41.54 0.05 Allowed 'General case' 0 C--N 1.323 -0.577 0 O-C-N 123.887 0.742 . . . . 0.0 110.432 179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -164.82 54.39 0.13 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 122.079 0.943 . . . . 0.0 110.988 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 ptp -157.33 164.91 37.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 121.671 -0.643 . . . . 0.0 110.906 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -150.68 171.91 16.4 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.305 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 172.7 135.79 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.27 0 O-C-N 123.563 0.539 . . . . 0.0 109.641 179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.78 -168.24 1.96 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.279 178.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.39 101.4 0.29 Allowed Glycine 0 C--O 1.218 -0.881 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -166.22 165.64 17.37 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-O 120.721 0.296 . . . . 0.0 110.635 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' CB ' ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -160.06 166.54 29.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.772 178.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -83.59 -170.39 3.04 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.773 1.296 . . . . 0.0 111.099 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.86 174.69 30.66 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.59 36.34 0.75 Allowed 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.368 0.604 . . . . 0.0 110.694 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.4 p -166.4 173.63 9.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.862 -0.524 . . . . 0.0 110.167 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 16' ' ' GLN . 13.2 m -53.44 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 124.42 1.075 . . . . 0.0 110.321 178.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HA ' ' CB ' ' A' ' 10' ' ' ARG . 43.0 tt0 -40.39 -54.13 2.49 Favored 'General case' 0 N--CA 1.444 -0.742 0 O-C-N 121.92 -0.488 . . . . 0.0 110.982 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -177.38 39.0 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.749 0 O-C-N 124.498 1.124 . . . . 0.0 109.935 178.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.4 -41.26 80.75 Favored 'General case' 0 C--O 1.207 -1.165 0 CA-C-O 117.301 -1.333 . . . . 0.0 107.987 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -41.24 -30.87 0.18 Allowed 'General case' 0 C--O 1.213 -0.859 0 CA-C-N 118.969 0.804 . . . . 0.0 111.044 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.29 -67.02 0.31 Allowed 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 121.405 0.621 . . . . 0.0 111.634 175.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 -28.72 34.82 Favored 'General case' 0 C--O 1.2 -1.543 0 O-C-N 120.249 -1.532 . . . . 0.0 109.299 -178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 t -59.24 -29.45 41.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 126.037 1.735 . . . . 0.0 109.132 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.7 -1.4 21.66 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 121.55 0.69 . . . . 0.0 111.399 177.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -152.39 23.26 0.62 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 123.941 0.896 . . . . 0.0 111.313 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.8 -91.49 0.13 Allowed 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -176.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.9 m-20 -52.08 171.16 0.05 Allowed 'General case' 0 CA--C 1.499 -1.016 0 O-C-N 125.563 1.789 . . . . 0.0 108.88 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.927 HD13 HG22 ' A' ' 70' ' ' VAL . 2.5 mm? -4.19 82.18 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.268 0 O-C-N 125.11 1.506 . . . . 0.0 112.165 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -137.3 41.09 2.44 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 124.424 2.059 . . . . 0.0 107.608 -171.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.425 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 19.6 t -175.87 -33.98 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.068 0 O-C-N 119.628 -1.92 . . . . 0.0 109.667 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.438 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 8.3 m -54.27 -53.39 54.38 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.636 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -73.25 -31.77 64.31 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.613 0.72 . . . . 0.0 110.23 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -63.01 -39.34 94.45 Favored 'General case' 0 C--O 1.21 -0.998 0 O-C-N 121.492 -0.755 . . . . 0.0 110.285 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 41.9 t80 -50.87 -44.24 59.66 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.392 1.477 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.48 -30.54 61.88 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.131 0.894 . . . . 0.0 109.929 178.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -66.7 -47.49 72.22 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.97 -167.3 1.1 Allowed 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 121.361 0.601 . . . . 0.0 110.268 -178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.62 -151.69 0.15 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.823 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 17.8 t -134.06 106.99 7.5 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.254 178.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.1 p -147.59 -178.98 6.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.809 178.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.3 ttm180 -88.34 -169.32 2.51 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.503 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.543 ' O ' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -179.84 145.71 0.23 Allowed 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 117.138 -1.411 . . . . 0.0 110.146 177.403 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.54 ' HA ' HG11 ' A' ' 47' ' ' VAL . 1.2 m -168.27 57.04 0.06 Allowed 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 126.717 2.511 . . . . 0.0 111.082 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.7 m -145.63 15.59 1.43 Allowed 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.661 0.743 . . . . 0.0 110.475 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -86.8 -123.6 1.64 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.423 -0.671 . . . . 0.0 111.423 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -87.02 -49.07 7.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.402 -0.399 . . . . 0.0 110.775 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 -153.15 117.08 4.79 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-O 121.045 0.45 . . . . 0.0 110.271 -177.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.543 HG11 ' O ' ' A' ' 41' ' ' ARG . 3.4 t -150.71 62.65 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-O 121.913 0.863 . . . . 0.0 109.347 -177.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.475 ' O ' HD12 ' A' ' 48' ' ' LEU . 0.4 OUTLIER -156.62 31.39 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.926 0.87 . . . . 0.0 109.674 -179.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -135.85 161.69 34.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 121.664 -0.647 . . . . 0.0 110.786 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.6 mtt -73.09 168.28 26.37 Favored Pre-proline 0 N--CA 1.441 -0.888 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.637 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -74.52 128.44 11.88 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.133 1.888 . . . . 0.0 111.648 178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.84 -101.67 0.15 Allowed Glycine 0 N--CA 1.45 -0.423 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -55.86 -43.92 77.58 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 124.761 0.918 . . . . 0.0 110.714 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 55' ' ' ASN . 0.5 OUTLIER -56.13 -172.3 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 124.875 1.359 . . . . 0.0 110.264 179.689 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 54' ' ' GLU . 12.5 t30 -38.32 102.8 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 121.712 -0.617 . . . . 0.0 111.159 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.68 109.74 1.51 Allowed 'General case' 0 N--CA 1.44 -0.962 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 -175.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -170.23 145.81 2.83 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -41.1 -40.1 1.42 Allowed 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 124.783 1.302 . . . . 0.0 110.999 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 166.74 112.88 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.604 0 O-C-N 125.17 1.544 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -167.15 79.18 0.2 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.26 -15.16 22.33 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.342 0.591 . . . . 0.0 110.579 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mt-30 -70.73 -63.56 1.07 Allowed 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 121.863 -0.523 . . . . 0.0 110.454 179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 110' ' ' ILE . 4.3 mp -60.56 -25.15 65.96 Favored 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -50.91 -30.3 14.35 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 117.916 0.326 . . . . 0.0 110.87 176.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.483 ' NE2' ' HE ' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -69.27 -32.62 71.93 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 118.358 -0.829 . . . . 0.0 110.306 178.37 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.717 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.6 t -73.11 -49.58 27.63 Favored 'General case' 0 C--O 1.205 -1.265 0 C-N-CA 124.087 0.955 . . . . 0.0 109.063 177.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -50.89 71.06 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 118.944 0.793 . . . . 0.0 109.945 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -62.18 -28.27 69.55 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 122.606 1.193 . . . . 0.0 109.998 177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.425 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 3.9 mm-40 -73.77 -48.1 34.14 Favored 'General case' 0 N--CA 1.447 -0.616 0 O-C-N 121.155 -0.966 . . . . 0.0 111.197 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.927 HG22 HD13 ' A' ' 27' ' ' LEU . 11.7 t -65.61 -13.77 15.97 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 C-N-CA 123.957 0.903 . . . . 0.0 108.995 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.8 tttm -71.8 -15.97 62.17 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 121.346 -0.846 . . . . 0.0 110.335 176.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -98.87 8.23 45.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 C-N-CA 122.744 0.418 . . . . 0.0 110.548 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.879 HG11 ' HB3' ' A' ' 78' ' ' GLN . 58.7 t -72.19 143.53 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.894 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.63 -61.18 2.53 Favored 'General case' 0 CA--C 1.503 -0.859 0 CA-C-O 117.797 -1.096 . . . . 0.0 109.657 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 158.43 -51.0 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.435 0 O-C-N 126.102 2.126 . . . . 0.0 110.54 -178.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.442 ' HB3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 pt-20 -112.09 3.09 17.1 Favored 'General case' 0 CA--C 1.504 -0.807 0 C-N-CA 123.775 0.83 . . . . 0.0 109.76 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 95.1 m -98.77 -0.84 41.85 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.879 ' HB3' HG11 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -63.16 -33.36 75.3 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -72.18 0.24 Allowed 'General case' 0 N--CA 1.434 -1.233 0 O-C-N 120.913 -1.117 . . . . 0.0 108.289 -178.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -47.03 -27.74 1.43 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 122.535 0.334 . . . . 0.0 110.993 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.704 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -57.9 -47.16 83.62 Favored 'General case' 0 N--CA 1.434 -1.249 0 C-N-CA 122.606 0.362 . . . . 0.0 111.112 175.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.491 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.9 mm -63.64 -37.85 80.71 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.279 0 C-N-CA 123.467 0.707 . . . . 0.0 109.686 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -16.98 18.77 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 120.117 -1.614 . . . . 0.0 111.062 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.445 ' O ' ' CD2' ' A' ' 84' ' ' TYR . 87.6 t80 -97.73 28.44 3.85 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 122.512 1.149 . . . . 0.0 112.331 177.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.503 HG22 ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -167.93 -38.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.655 0 O-C-N 120.569 -1.332 . . . . 0.0 108.571 -175.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.414 ' HB1' ' CE ' ' A' ' 119' ' ' MET . . . -76.15 6.84 4.81 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 120.099 -1.626 . . . . 0.0 109.393 177.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.924 ' HA ' HD12 ' A' ' 90' ' ' ILE . 2.4 tp10 -162.36 -40.67 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.203 0 CA-C-O 121.48 0.657 . . . . 0.0 110.884 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.417 ' HB2' ' C ' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.598 ' O ' HD23 ' A' ' 95' ' ' LEU . 3.9 pt20 -65.47 -43.48 90.15 Favored 'General case' 0 C--O 1.204 -1.296 0 CA-C-O 117.437 -1.268 . . . . 0.0 108.931 179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.924 HD12 ' HA ' ' A' ' 87' ' ' GLU . 14.3 mt -50.24 -33.84 10.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 119.384 0.993 . . . . 0.0 109.465 -178.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -91.83 -26.15 18.65 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.796 176.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -72.51 -59.82 2.54 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 123.222 0.609 . . . . 0.0 110.241 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.519 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -75.67 -173.76 34.83 Favored Glycine 0 N--CA 1.436 -1.311 0 CA-C-O 122.818 1.232 . . . . 0.0 111.661 178.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -87.8 47.93 1.57 Allowed 'General case' 0 C--O 1.204 -1.295 0 CA-C-N 114.841 -0.68 . . . . 0.0 110.346 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.942 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -84.4 0.65 48.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 21.4 m-70 -64.95 176.93 1.08 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-O 121.448 0.642 . . . . 0.0 110.379 178.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.22 -78.48 1.99 Allowed Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -175.07 48.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 123.583 1.659 . . . . 0.0 110.143 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -141.64 31.97 1.65 Allowed 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.351 -1.468 . . . . 0.0 109.336 -178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.521 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -87.43 -42.56 12.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.808 -0.557 . . . . 0.0 110.09 179.514 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.58 -28.66 69.79 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 122.211 1.005 . . . . 0.0 109.512 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -23.91 63.93 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 121.285 -0.884 . . . . 0.0 110.211 178.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.942 HG21 ' HG ' ' A' ' 95' ' ' LEU . 45.0 t -80.57 -20.72 11.53 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 123.941 0.776 . . . . 0.0 109.717 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.15 -76.78 0.04 OUTLIER 'General case' 0 N--CA 1.443 -0.802 0 O-C-N 123.758 0.661 . . . . 0.0 109.581 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -53.86 -38.88 65.17 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-O 118.087 -0.958 . . . . 0.0 109.578 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.707 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -46.25 -47.92 17.98 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.223 0.952 . . . . 0.0 110.35 179.145 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.636 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -71.11 -43.61 67.31 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.059 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -54.56 -30.17 49.91 Favored Glycine 0 C--N 1.338 0.658 0 O-C-N 123.3 0.375 . . . . 0.0 112.24 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -57.85 -45.02 86.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 O-C-N 121.979 -0.718 . . . . 0.0 109.702 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 63' ' ' LEU . 3.1 mm -78.62 -29.19 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.771 HG13 ' HA ' ' A' ' 116' ' ' VAL . 77.3 t -55.97 -55.37 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 178.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -26.57 59.61 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 124.287 0.992 . . . . 0.0 110.439 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.585 ' CB ' HD23 ' A' ' 63' ' ' LEU . 54.5 m -77.05 -77.01 0.15 Allowed 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 123.971 0.794 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.504 ' O ' HG21 ' A' ' 70' ' ' VAL . 2.3 t -149.08 47.23 0.99 Allowed 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 178.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -139.17 21.07 2.98 Favored Glycine 0 C--O 1.219 -0.787 0 N-CA-C 110.009 -1.237 . . . . 0.0 110.009 -179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.771 ' HA ' HG13 ' A' ' 111' ' ' VAL . 5.4 p -73.51 106.77 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 123.686 0.794 . . . . 0.0 111.353 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.669 ' HD2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -147.88 -72.48 0.21 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.347 -175.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 -2.28 10.37 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.746 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -98.43 -2.08 39.91 Favored 'General case' 0 N--CA 1.442 -0.847 0 O-C-N 123.582 0.551 . . . . 0.0 111.598 178.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.619 ' HB3' HG23 ' A' ' 116' ' ' VAL . 20.2 ttt85 -160.03 -45.65 0.05 OUTLIER 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 123.002 0.521 . . . . 0.0 110.395 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.664 ' HB2' HG22 ' A' ' 116' ' ' VAL . 1.5 tt0 -79.87 -161.03 0.31 Allowed 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 124.07 0.856 . . . . 0.0 109.89 -179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.547 HG22 ' H ' ' A' ' 123' ' ' ARG . 4.7 m -152.42 178.6 9.38 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 124.11 0.881 . . . . 0.0 110.314 -179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.547 ' H ' HG22 ' A' ' 122' ' ' THR . 4.3 mtt180 -59.4 98.83 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 123.635 0.584 . . . . 0.0 111.123 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 122' ' ' THR . 19.0 p -91.3 -75.48 0.47 Allowed 'General case' 0 C--N 1.316 -0.849 0 O-C-N 123.82 0.7 . . . . 0.0 109.501 -178.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.442 ' OXT' ' HB3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--O 1.261 1.696 0 O-C-N 124.542 1.151 . . . . 0.0 110.279 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -140.73 -76.67 0.31 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.559 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 4' ' ' MET . 4.9 p90 -176.13 -163.04 0.1 Allowed 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.058 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.434 ' N ' ' CD2' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -178.0 166.77 2.03 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 123.095 0.558 . . . . 0.0 111.209 177.248 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -152.81 178.34 9.76 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.442 178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 170.73 147.94 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.637 0.732 . . . . 0.0 109.653 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.34 176.1 9.26 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.786 178.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -131.83 -113.93 1.55 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -168.92 144.82 3.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.992 0.425 . . . . 0.0 110.789 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.44 167.9 17.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 121.147 0.498 . . . . 0.0 110.562 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -147.26 -177.49 5.71 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.59 178.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 13' ' ' SER . . . 107.77 155.07 18.77 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.509 -1.037 . . . . 0.0 110.509 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 12' ' ' GLY . 0.5 OUTLIER 159.99 -31.57 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 123.125 0.57 . . . . 0.0 110.516 -179.974 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.1 p -166.77 -171.38 1.82 Allowed 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.424 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -56.02 -170.62 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.248 1.023 . . . . 0.0 108.827 -179.108 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.419 ' C ' ' O ' ' A' ' 15' ' ' SER . 50.0 tt0 -40.19 -61.25 0.91 Allowed 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.471 -0.768 . . . . 0.0 110.652 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -178.28 40.48 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.887 0 CA-C-O 121.985 0.897 . . . . 0.0 110.391 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.437 ' SG ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -78.98 -28.85 43.58 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-O 117.376 -1.297 . . . . 0.0 108.421 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -40.6 -31.61 0.16 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.848 0.859 . . . . 0.0 110.764 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.63 -76.42 0.07 Allowed 'General case' 0 N--CA 1.421 -1.891 0 CA-C-O 121.179 0.514 . . . . 0.0 111.545 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' HB2' ' CE ' ' A' ' 25' ' ' LYS . 11.1 pt-20 -59.68 -20.03 53.53 Favored 'General case' 0 N--CA 1.441 -0.908 0 O-C-N 121.642 -0.661 . . . . 0.0 111.436 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.736 HG22 ' OD2' ' A' ' 26' ' ' ASP . 2.2 t -66.1 -45.63 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.687 0 C-N-CA 124.924 1.289 . . . . 0.0 108.28 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -79.89 44.88 0.67 Allowed 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 121.94 0.876 . . . . 0.0 110.795 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -153.86 -44.85 0.09 Allowed 'General case' 0 N--CA 1.438 -1.063 0 O-C-N 120.64 -1.287 . . . . 0.0 110.588 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CE ' ' HB2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -114.57 -54.12 2.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 123.681 0.613 . . . . 0.0 109.911 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.736 ' OD2' HG22 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -57.05 159.19 4.41 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 114.813 -2.518 . . . . 0.0 108.046 -178.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.876 HD23 ' HB3' ' A' ' 81' ' ' ALA . 2.8 mm? -5.33 80.4 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 127.199 2.812 . . . . 0.0 112.39 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -135.11 37.23 3.0 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 123.93 1.824 . . . . 0.0 107.565 -171.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.424 ' CB ' ' HG3' ' A' ' 69' ' ' GLN . 12.7 t -176.3 -34.88 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.329 0 O-C-N 119.415 -2.053 . . . . 0.0 109.731 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.7 m -53.96 -55.37 27.72 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-O 121.411 0.625 . . . . 0.0 109.342 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.577 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.02 -32.37 65.07 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 122.338 1.066 . . . . 0.0 109.597 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp85 -62.6 -38.47 90.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 O-C-N 120.785 -1.197 . . . . 0.0 110.495 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 61.6 t80 -53.04 -44.3 67.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 124.955 1.302 . . . . 0.0 110.42 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.763 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.64 -26.73 60.08 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.711 178.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -42.67 77.44 Favored 'General case' 0 N--CA 1.438 -1.059 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.26 -163.0 0.5 Allowed 'General case' 0 N--CA 1.432 -1.335 0 CA-C-O 121.391 0.615 . . . . 0.0 110.723 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.7 t -152.5 -42.77 0.1 Allowed 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 121.346 0.593 . . . . 0.0 110.816 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.3 m -153.29 125.2 7.85 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.302 0.572 . . . . 0.0 109.863 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.6 -163.46 1.79 Allowed 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.5 0.667 . . . . 0.0 110.214 179.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 11.4 ttm-85 -153.65 125.82 7.94 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 122.024 -0.422 . . . . 0.0 110.152 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.62 ' HG3' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -46.49 151.06 0.59 Allowed 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.402 179.038 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 8.8 t -156.35 24.53 0.35 Allowed 'General case' 0 C--N 1.321 -0.632 0 O-C-N 124.043 0.84 . . . . 0.0 110.468 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.1 t -162.69 143.1 9.64 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.674 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 96.91 122.07 4.23 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.557 -1.017 . . . . 0.0 110.557 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 mp0 -75.71 -4.28 39.49 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 121.043 0.449 . . . . 0.0 110.713 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.63 68.56 0.72 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 122.551 1.167 . . . . 0.0 110.187 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.678 ' O ' HG12 ' A' ' 47' ' ' VAL . 47.2 t -142.26 60.36 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 122.985 1.374 . . . . 0.0 108.67 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -119.86 51.88 1.15 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 120.79 -1.194 . . . . 0.0 109.478 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -137.94 161.32 36.98 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.778 -0.576 . . . . 0.0 110.909 179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.7 mmt -98.2 160.5 28.1 Favored Pre-proline 0 N--CA 1.44 -0.937 0 O-C-N 124.205 0.941 . . . . 0.0 112.118 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -72.0 132.58 20.04 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.726 2.284 . . . . 0.0 112.482 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.33 -82.76 0.41 Allowed Glycine 0 C--N 1.336 0.57 0 O-C-N 123.919 0.762 . . . . 0.0 111.199 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.437 ' O ' HD22 ' A' ' 63' ' ' LEU . 0.6 OUTLIER -167.28 -77.58 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -110.61 119.1 38.04 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.488 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 20.8 t30 -74.24 61.76 0.89 Allowed 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.798 0.809 . . . . 0.0 109.639 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 57' ' ' GLN . 2.3 tt0 -108.87 -76.1 0.62 Allowed 'General case' 0 N--CA 1.427 -1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.067 -179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' N ' ' CG ' ' A' ' 56' ' ' GLN . 0.0 OUTLIER -111.86 -6.53 14.26 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -178.019 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -117.4 -156.83 0.64 Allowed 'General case' 0 N--CA 1.434 -1.234 0 CA-C-O 121.198 0.523 . . . . 0.0 110.672 179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -104.33 139.0 39.94 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-O 122.056 0.931 . . . . 0.0 111.004 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.447 ' HB3' ' CA ' ' A' ' 55' ' ' ASN . 12.2 t -166.74 74.34 0.16 Allowed 'General case' 0 C--O 1.199 -1.588 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.89 -22.48 2.24 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.883 -1.136 . . . . 0.0 110.664 178.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.536 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.6 mm-40 -69.56 -69.22 0.36 Allowed 'General case' 0 N--CA 1.426 -1.632 0 CA-C-O 121.672 0.748 . . . . 0.0 111.32 178.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.084 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -68.07 -31.84 71.76 Favored 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 121.807 -0.558 . . . . 0.0 109.573 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.488 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 32.2 tt0 -51.22 -28.02 10.46 Favored 'General case' 0 N--CA 1.433 -1.32 0 C-N-CA 125.284 1.434 . . . . 0.0 109.506 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.412 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 1.9 mt-30 -72.23 -32.04 66.36 Favored 'General case' 0 C--O 1.193 -1.887 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.536 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.647 ' SG ' HG22 ' A' ' 110' ' ' ILE . 4.9 t -73.67 -49.99 23.14 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.8 1.24 . . . . 0.0 109.239 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.3 t -60.99 -44.36 97.5 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -68.66 -24.86 64.58 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-O 121.383 0.611 . . . . 0.0 110.14 178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.424 ' HG3' ' CB ' ' A' ' 29' ' ' SER . 4.7 mm-40 -78.59 -45.74 20.98 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 121.789 0.804 . . . . 0.0 110.737 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 1.021 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 33.8 t -73.34 -9.58 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.025 0 O-C-N 120.985 -1.072 . . . . 0.0 108.838 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 tptm -74.98 -17.2 60.57 Favored 'General case' 0 N--CA 1.437 -1.104 0 O-C-N 120.964 -1.085 . . . . 0.0 109.807 178.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.429 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 0.8 OUTLIER -99.31 5.64 46.44 Favored 'General case' 0 N--CA 1.437 -1.109 0 O-C-N 123.165 0.291 . . . . 0.0 110.651 178.221 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.638 HG23 ' CG ' ' A' ' 26' ' ' ASP . 0.6 OUTLIER -72.24 164.87 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.193 0 CA-C-O 121.102 0.477 . . . . 0.0 109.747 179.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 2.9 mmt180 -71.88 -71.65 0.26 Allowed 'General case' 0 C--O 1.203 -1.375 0 CA-C-O 117.338 -1.315 . . . . 0.0 109.633 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 159.84 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 126.795 2.559 . . . . 0.0 110.111 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -123.57 -1.34 8.54 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.356 0.598 . . . . 0.0 110.326 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.435 ' HB3' ' CG2' ' A' ' 22' ' ' VAL . 81.1 m -94.6 19.03 10.41 Favored 'General case' 0 N--CA 1.437 -1.118 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.567 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 15.9 mm-40 -64.38 -79.38 0.04 OUTLIER 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 122' ' ' THR . 1.3 m -47.67 -58.43 4.29 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-O 117.528 -1.225 . . . . 0.0 108.687 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -38.2 -35.95 0.19 Allowed 'General case' 0 N--CA 1.446 -0.638 0 O-C-N 124.537 1.148 . . . . 0.0 111.857 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.876 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -66.47 -56.83 9.06 Favored 'General case' 0 N--CA 1.424 -1.77 0 C-N-CA 123.229 0.611 . . . . 0.0 111.418 174.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.593 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 35.3 mm -54.32 -32.88 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.124 0 O-C-N 120.689 -1.257 . . . . 0.0 111.031 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.46 ' CE ' ' HA ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -69.79 -9.02 53.03 Favored 'General case' 0 N--CA 1.444 -0.737 0 O-C-N 121.161 -0.962 . . . . 0.0 109.107 179.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -112.11 -65.27 1.19 Allowed 'General case' 0 N--CA 1.425 -1.698 0 C-N-CA 124.507 1.123 . . . . 0.0 111.354 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 86' ' ' ALA . 9.4 tp -58.62 -53.28 49.17 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.341 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.612 ' C ' HD12 ' A' ' 90' ' ' ILE . . . -76.06 53.99 0.82 Allowed 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.5 ' N ' HD12 ' A' ' 90' ' ' ILE . 2.1 tt0 -173.12 -55.19 0.02 OUTLIER 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.593 -0.692 . . . . 0.0 111.261 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -50.33 -47.89 55.61 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.53 ' O ' HD23 ' A' ' 95' ' ' LEU . 4.2 pt20 -70.82 -42.01 70.79 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.63 -0.669 . . . . 0.0 109.808 179.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.612 HD12 ' C ' ' A' ' 86' ' ' ALA . 6.1 mt -58.54 -30.43 41.25 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.254 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.413 ' HA ' ' NE2' ' A' ' 96' ' ' HIS . 67.0 mt-30 -86.0 -37.61 18.79 Favored 'General case' 0 N--CA 1.426 -1.666 0 O-C-N 121.233 -0.917 . . . . 0.0 110.13 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -62.33 1.54 Allowed 'General case' 0 N--CA 1.433 -1.31 0 CA-C-O 121.437 0.637 . . . . 0.0 109.932 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.533 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -56.32 -177.39 0.32 Allowed Glycine 0 N--CA 1.431 -1.691 0 CA-C-O 122.872 1.262 . . . . 0.0 111.214 178.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -87.37 42.15 1.02 Allowed 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 122.03 0.919 . . . . 0.0 110.608 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.784 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.28 15.98 10.91 Favored 'General case' 0 N--CA 1.441 -0.924 0 O-C-N 120.475 -1.391 . . . . 0.0 109.144 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.413 ' NE2' ' HA ' ' A' ' 91' ' ' GLN . 3.6 m170 -101.73 -177.63 3.48 Favored 'General case' 0 N--CA 1.435 -1.196 0 O-C-N 121.308 -0.87 . . . . 0.0 110.372 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.08 -63.39 3.88 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -178.11 37.08 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 123.282 1.515 . . . . 0.0 110.593 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -137.37 28.43 2.77 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 120.325 -1.484 . . . . 0.0 109.739 -178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -48.4 6.75 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 121.641 -0.662 . . . . 0.0 109.837 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -59.02 -26.84 64.91 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 122.136 0.97 . . . . 0.0 109.634 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.75 -26.67 65.35 Favored 'General case' 0 N--CA 1.437 -1.119 0 O-C-N 121.009 -1.057 . . . . 0.0 110.118 178.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.784 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.8 t -79.47 -32.05 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 O-C-N 121.466 -0.771 . . . . 0.0 110.231 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.01 -32.2 71.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.627 0.727 . . . . 0.0 109.49 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.69 -36.43 70.58 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 121.592 -0.692 . . . . 0.0 110.406 178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.763 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -59.23 -63.21 1.38 Allowed 'General case' 0 C--O 1.202 -1.42 0 CA-C-O 121.451 0.643 . . . . 0.0 110.529 179.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.633 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -49.22 -51.79 31.02 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -39.83 -36.54 0.79 Allowed Glycine 0 C--N 1.345 1.049 0 O-C-N 124.232 0.957 . . . . 0.0 111.635 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -52.64 -59.67 4.18 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.328 0.651 . . . . 0.0 111.227 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 1.084 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -69.61 -30.17 44.1 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.802 HG21 ' CB ' ' A' ' 119' ' ' MET . 96.5 t -56.11 -63.77 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.293 0 O-C-N 120.809 -1.182 . . . . 0.0 109.174 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 47.7 p -55.44 -19.29 8.9 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.279 0.362 . . . . 0.0 110.907 178.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.538 ' HB3' HD23 ' A' ' 63' ' ' LEU . 1.5 m -77.06 -72.38 0.35 Allowed 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 122.485 1.136 . . . . 0.0 110.147 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -156.62 31.72 0.32 Allowed 'General case' 0 N--CA 1.434 -1.271 0 O-C-N 120.543 -1.348 . . . . 0.0 108.802 179.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.521 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -129.18 36.3 2.42 Favored Glycine 0 N--CA 1.439 -1.152 0 O-C-N 120.843 -1.161 . . . . 0.0 110.404 -179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.565 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -73.02 113.58 11.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 C-N-CA 123.52 0.728 . . . . 0.0 110.725 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 1.021 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 1.3 mmt180 -146.4 -73.4 0.22 Allowed 'General case' 0 C--O 1.193 -1.892 0 CA-C-O 118.075 -0.964 . . . . 0.0 109.784 -177.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.0 -2.02 7.12 Favored 'General case' 0 N--CA 1.443 -0.8 0 O-C-N 124.609 1.193 . . . . 0.0 108.978 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.802 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.53 9.6 42.01 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-O 121.648 0.737 . . . . 0.0 111.561 179.547 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HB3' HG23 ' A' ' 116' ' ' VAL . 9.0 ttm180 -160.03 -48.94 0.05 Allowed 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 121.62 -0.675 . . . . 0.0 110.421 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.555 ' OE1' HG22 ' A' ' 124' ' ' THR . 6.6 tt0 -133.28 -148.84 0.35 Allowed 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.107 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.744 HG23 ' SG ' ' A' ' 79' ' ' CYS . 2.7 m -154.59 -159.19 0.93 Allowed 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 123.153 0.581 . . . . 0.0 110.558 -178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.627 ' H ' HG22 ' A' ' 122' ' ' THR . 0.1 OUTLIER -49.1 118.83 2.86 Favored 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 122.644 0.377 . . . . 0.0 110.999 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.607 HG23 ' O ' ' A' ' 122' ' ' THR . 74.6 p -110.0 -40.89 4.61 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 117.577 -1.202 . . . . 0.0 110.65 -178.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.548 0.887 0 O-C-N 125.295 1.622 . . . . 0.0 109.332 178.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.524 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -152.2 164.9 36.4 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.717 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -57.22 164.93 1.54 Allowed 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 124.123 0.889 . . . . 0.0 112.109 177.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mtp -176.69 162.32 2.19 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.141 178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -85.48 150.79 24.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 118.72 -0.657 . . . . 0.0 110.812 177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 167.49 111.07 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 124.548 1.155 . . . . 0.0 110.138 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -141.4 141.99 33.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.178 -0.915 . . . . 0.0 109.842 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.71 -106.16 0.46 Allowed Glycine 0 C--O 1.219 -0.79 0 O-C-N 125.707 1.879 . . . . 0.0 109.555 -176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -148.47 -58.13 0.23 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.717 0.77 . . . . 0.0 110.052 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.06 -65.04 0.07 Allowed 'General case' 0 CA--C 1.51 -0.569 0 O-C-N 121.478 -0.764 . . . . 0.0 110.856 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.85 179.5 7.67 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.018 0.527 . . . . 0.0 111.096 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 141.61 145.68 4.58 Favored Glycine 0 N--CA 1.45 -0.424 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 t -92.94 -23.71 18.65 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.302 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 80' ' ' GLU . 36.1 p -165.18 156.64 14.74 Favored 'General case' 0 CA--C 1.504 -0.815 0 C-N-CA 124.531 1.132 . . . . 0.0 109.293 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.505 ' CB ' ' HB2' ' A' ' 18' ' ' CYS . 0.3 OUTLIER -61.91 -154.98 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 123.176 1.465 . . . . 0.0 111.044 178.681 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -96.37 -21.99 17.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 119.541 -1.975 . . . . 0.0 111.302 176.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -177.25 34.84 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.558 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.9 t -78.19 -24.38 47.18 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 178.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.532 ' HG3' ' CD2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.64 -46.0 1.16 Allowed 'General case' 0 C--O 1.213 -0.824 0 CA-C-N 121.202 1.819 . . . . 0.0 112.635 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -75.83 0.03 OUTLIER 'General case' 0 C--O 1.207 -1.152 0 C-N-CA 123.236 0.615 . . . . 0.0 111.977 173.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -53.18 -28.52 26.92 Favored 'General case' 0 C--O 1.218 -0.573 0 O-C-N 121.086 -1.009 . . . . 0.0 112.91 176.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 18' ' ' CYS . 25.4 t -61.97 -51.26 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 125.924 1.689 . . . . 0.0 107.553 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.502 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -77.15 41.75 0.31 Allowed 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 112.267 179.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -150.03 -45.01 0.13 Allowed 'General case' 0 C--N 1.32 -0.707 0 O-C-N 120.121 -1.612 . . . . 0.0 109.776 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CE ' ' O ' ' A' ' 72' ' ' GLN . 5.8 ptmt -116.93 -50.08 2.6 Favored 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 124.037 0.836 . . . . 0.0 110.128 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HA ' ' CG2' ' A' ' 73' ' ' VAL . 0.8 OUTLIER -61.99 160.03 13.17 Favored 'General case' 0 CA--C 1.485 -1.521 0 CA-C-O 115.541 -2.171 . . . . 0.0 109.197 178.855 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.788 ' CD1' HG22 ' A' ' 70' ' ' VAL . 0.7 OUTLIER -7.97 86.56 0.0 OUTLIER 'General case' 0 CA--C 1.505 -0.77 0 C-N-CA 125.875 1.67 . . . . 0.0 111.293 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 p -139.59 30.83 2.09 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.733 1.254 . . . . 0.0 108.174 -170.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -176.14 -33.29 0.01 OUTLIER 'General case' 0 C--O 1.203 -1.364 0 CA-C-O 118.235 -0.888 . . . . 0.0 108.961 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HA ' HG21 ' A' ' 110' ' ' ILE . 18.7 m -56.07 -55.33 34.2 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 119.965 1.257 . . . . 0.0 110.578 178.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.634 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.1 OUTLIER -73.29 -31.63 64.16 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-O 121.875 0.845 . . . . 0.0 109.335 178.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -61.68 -45.24 94.86 Favored 'General case' 0 C--O 1.199 -1.581 0 O-C-N 120.055 -1.653 . . . . 0.0 111.133 177.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -46.1 -44.44 15.61 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 127.431 2.292 . . . . 0.0 109.989 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.776 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.65 -31.08 59.67 Favored 'General case' 0 N--CA 1.444 -0.767 0 O-C-N 124.541 1.151 . . . . 0.0 109.776 179.714 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -66.76 -51.58 54.22 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.295 0.638 . . . . 0.0 110.154 177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -78.47 -167.71 1.15 Allowed 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 124.745 1.218 . . . . 0.0 110.589 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.7 t -84.92 -46.82 10.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.594 178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -142.55 -146.5 0.19 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -179.84 90.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 123.821 0.848 . . . . 0.0 109.489 -175.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -168.83 111.88 0.54 Allowed 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.823 -0.548 . . . . 0.0 109.747 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -176.65 171.05 2.34 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 123.681 0.613 . . . . 0.0 110.211 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 95.8 p -86.1 43.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.006 0.522 . . . . 0.0 111.334 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 41.4 m -70.75 -1.51 11.71 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.61 -0.681 . . . . 0.0 112.173 177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.95 -119.83 3.35 Favored Glycine 0 N--CA 1.444 -0.785 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -162.25 -39.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.539 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -127.46 103.44 7.36 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.696 -178.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 57.5 t -154.0 88.78 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 -176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 177.11 -34.36 0.01 OUTLIER 'General case' 0 C--O 1.226 -0.177 0 O-C-N 124.421 1.075 . . . . 0.0 109.892 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.29 2.32 7.07 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.374 179.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 15.8 mmt -88.64 164.26 32.67 Favored Pre-proline 0 N--CA 1.433 -1.299 0 O-C-N 123.827 0.704 . . . . 0.0 112.403 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -75.53 52.96 3.41 Favored 'Trans proline' 0 C--O 1.241 0.659 0 C-N-CA 123.04 2.493 . . . . 0.0 111.606 177.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.14 -39.43 0.69 Allowed Glycine 0 N--CA 1.429 -1.772 0 CA-C-O 114.362 -3.465 . . . . 0.0 110.875 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -62.75 1.44 Allowed 'General case' 0 CA--C 1.518 -0.283 0 O-C-N 126.908 2.181 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -69.55 66.78 0.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 122.636 1.207 . . . . 0.0 110.613 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -85.95 -168.74 2.34 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 120.522 -1.361 . . . . 0.0 108.835 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.08 -71.0 0.09 Allowed 'General case' 0 N--CA 1.447 -0.609 0 O-C-N 123.928 0.767 . . . . 0.0 112.095 177.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -115.49 130.01 56.74 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 124.116 0.885 . . . . 0.0 110.488 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -53.12 -54.17 39.68 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.15 0.5 . . . . 0.0 111.075 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -78.8 59.23 2.51 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 123.1 1.428 . . . . 0.0 111.049 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.1 p -166.04 40.51 0.06 Allowed 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 120.178 -1.576 . . . . 0.0 108.873 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -55.56 -20.38 13.14 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.705 0.764 . . . . 0.0 110.773 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -60.28 -56.69 18.47 Favored 'General case' 0 N--CA 1.437 -1.089 0 O-C-N 121.398 -0.813 . . . . 0.0 111.734 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.909 HD11 HD12 ' A' ' 110' ' ' ILE . 6.0 mp -72.08 -26.07 62.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.52 -0.738 . . . . 0.0 109.239 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -51.57 -31.4 24.42 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.45 -0.781 . . . . 0.0 111.041 175.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.1 mm-40 -70.54 -32.86 70.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 117.261 -1.352 . . . . 0.0 110.798 177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' HG22 ' A' ' 110' ' ' ILE . 2.6 t -71.92 -49.3 38.92 Favored 'General case' 0 C--O 1.2 -1.505 0 C-N-CA 124.606 1.162 . . . . 0.0 109.054 175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.0 t -57.92 -52.11 66.84 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-N 121.641 2.019 . . . . 0.0 110.683 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -58.93 -20.66 54.0 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 123.34 0.4 . . . . 0.0 111.898 175.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -84.97 -48.56 9.13 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 111.106 178.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.788 HG22 ' CD1' ' A' ' 27' ' ' LEU . 14.9 t -72.47 -11.08 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.378 0 O-C-N 120.453 -1.405 . . . . 0.0 109.61 177.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ttpt -75.37 -14.91 60.5 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 120.779 -1.201 . . . . 0.0 110.141 175.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.403 ' O ' ' CE ' ' A' ' 25' ' ' LYS . 3.1 mm-40 -98.97 8.0 45.45 Favored 'General case' 0 N--CA 1.441 -0.911 0 O-C-N 123.41 0.444 . . . . 0.0 110.475 177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.489 ' CG2' ' HA ' ' A' ' 26' ' ' ASP . 3.1 t -68.76 163.01 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 CA-C-N 118.547 0.612 . . . . 0.0 110.423 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.418 ' N ' ' CG1' ' A' ' 73' ' ' VAL . 9.1 mmt180 -83.97 -68.67 0.7 Allowed 'General case' 0 CA--C 1.502 -0.884 0 CA-C-O 117.735 -1.126 . . . . 0.0 111.221 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 157.15 -41.95 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 O-C-N 125.743 1.902 . . . . 0.0 110.57 -176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -100.95 -2.7 31.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.999 0.428 . . . . 0.0 110.824 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -111.96 -3.43 14.82 Favored 'General case' 0 N--CA 1.417 -2.076 0 CA-C-O 116.462 -1.732 . . . . 0.0 108.676 177.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.461 ' CB ' HG11 ' A' ' 73' ' ' VAL . 1.2 pt20 -62.74 -41.59 99.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 119.895 1.225 . . . . 0.0 109.075 178.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -75.98 -64.18 1.15 Allowed 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 -174.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HG2' ' CB ' ' A' ' 14' ' ' SER . 42.4 tp10 -50.36 -28.79 8.63 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 118.211 0.46 . . . . 0.0 111.256 178.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.829 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -54.37 -43.52 71.42 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-O 116.356 -1.783 . . . . 0.0 112.078 173.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.572 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 11.1 mm -71.69 -41.33 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 C-N-CA 125.424 1.49 . . . . 0.0 110.732 173.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -68.44 -0.96 5.56 Favored 'General case' 0 C--O 1.213 -0.868 0 O-C-N 120.746 -1.221 . . . . 0.0 111.162 176.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.532 ' CD2' ' HG3' ' A' ' 19' ' ' ARG . 23.9 t80 -112.6 -64.36 1.31 Allowed 'General case' 0 C--O 1.194 -1.823 0 CA-C-O 116.99 -1.481 . . . . 0.0 107.566 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.829 HG22 ' O ' ' A' ' 81' ' ' ALA . 4.9 tt -60.79 -38.86 80.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 120.693 1.588 . . . . 0.0 109.295 -177.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -71.11 -69.36 0.38 Allowed 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 116.893 -1.527 . . . . 0.0 107.817 177.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -50.51 -22.79 2.1 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 124.542 1.152 . . . . 0.0 111.842 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -63.94 -80.83 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 125.413 1.485 . . . . 0.0 108.713 178.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -59.11 -33.32 70.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 117.68 -1.153 . . . . 0.0 108.668 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.536 ' HA ' HD23 ' A' ' 95' ' ' LEU . 46.8 mt -52.62 -48.12 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 CA-C-N 119.811 1.187 . . . . 0.0 109.751 177.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -70.47 -54.35 12.63 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.765 178.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -52.3 -56.5 14.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 124.546 1.153 . . . . 0.0 111.241 -179.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.47 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -64.22 -178.96 6.02 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-O 123.988 1.882 . . . . 0.0 112.279 175.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -84.7 33.44 0.52 Allowed 'General case' 0 C--O 1.201 -1.456 0 O-C-N 120.185 -1.774 . . . . 0.0 110.988 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.877 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.2 OUTLIER -93.24 -1.87 55.71 Favored 'General case' 0 C--N 1.313 -0.995 0 O-C-N 119.278 -2.139 . . . . 0.0 107.49 -179.081 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.451 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -82.95 179.13 7.86 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 119.125 -2.234 . . . . 0.0 111.894 176.127 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 83.9 -67.24 3.75 Favored Glycine 0 C--O 1.22 -0.768 0 CA-C-O 117.833 -1.537 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -177.39 40.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 123.722 1.725 . . . . 0.0 110.632 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.405 ' HA ' ' HD3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -137.18 9.94 3.0 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 120.127 -1.608 . . . . 0.0 109.02 -175.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -75.08 -37.43 61.58 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -176.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -63.63 -24.61 67.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 121.34 0.591 . . . . 0.0 109.515 -179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.405 ' HD3' ' HA ' ' A' ' 99' ' ' GLU . 7.3 mtp85 -71.69 -24.7 61.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 O-C-N 121.934 -0.479 . . . . 0.0 110.497 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.877 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -83.51 -30.33 7.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 O-C-N 121.404 -0.81 . . . . 0.0 110.159 177.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.23 -32.4 62.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.842 0.746 . . . . 0.0 110.824 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.98 -25.87 62.89 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 118.336 -0.84 . . . . 0.0 111.192 176.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.776 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -80.04 -55.19 5.13 Favored 'General case' 0 N--CA 1.435 -1.222 0 CA-C-O 123.504 1.621 . . . . 0.0 109.4 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.634 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -64.45 -42.96 95.68 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 119.415 -2.053 . . . . 0.0 110.362 -178.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.15 -34.84 4.54 Favored Glycine 0 N--CA 1.445 -0.747 0 O-C-N 124.145 0.903 . . . . 0.0 112.402 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -54.1 -54.31 41.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.949 0.88 . . . . 0.0 111.05 176.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.909 HD12 HD11 ' A' ' 63' ' ' LEU . 2.3 mm -73.45 -29.41 27.37 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.619 0 O-C-N 120.653 -1.28 . . . . 0.0 108.663 -178.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.695 HG11 ' HB3' ' A' ' 119' ' ' MET . 75.0 t -57.9 -53.45 45.08 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.5 p -57.1 -29.06 63.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.327 177.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.794 ' HB2' HD23 ' A' ' 63' ' ' LEU . 35.3 t -71.57 -76.22 0.11 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 124.127 0.892 . . . . 0.0 109.846 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 5.8 t -150.82 41.97 0.78 Allowed 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -133.52 24.55 3.7 Favored Glycine 0 C--O 1.221 -0.67 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.679 ' HA ' HG13 ' A' ' 111' ' ' VAL . 2.5 p -70.68 99.86 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.171 0 C-N-CA 124.785 1.234 . . . . 0.0 111.324 179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.629 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.0 OUTLIER -142.53 -90.56 0.13 Allowed 'General case' 0 C--O 1.198 -1.618 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.968 -177.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' CYS . 0.1 OUTLIER -100.88 -0.54 36.66 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.387 0.675 . . . . 0.0 110.754 175.158 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.695 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -96.88 3.78 51.99 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.972 178.406 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.448 ' HB3' HG23 ' A' ' 116' ' ' VAL . 21.3 ttt180 -155.68 -71.89 0.11 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 122.919 0.488 . . . . 0.0 109.778 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.637 ' HG3' ' OXT' ' A' ' 125' ' ' ASN . 1.8 mm-40 -85.61 -167.14 1.73 Allowed 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.944 0.878 . . . . 0.0 109.39 -178.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 26.3 p -93.92 -153.77 0.38 Allowed 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 122.419 1.104 . . . . 0.0 109.984 -179.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.408 ' HA ' ' HB2' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -50.86 -36.13 36.24 Favored 'General case' 0 C--O 1.211 -0.937 0 O-C-N 120.759 -1.213 . . . . 0.0 111.898 177.612 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.93 147.33 50.09 Favored 'General case' 0 CA--C 1.489 -1.378 0 O-C-N 124.603 1.189 . . . . 0.0 108.312 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.637 ' OXT' ' HG3' ' A' ' 121' ' ' GLN . 8.2 t30 . . . . . 0 CA--C 1.581 2.151 0 O-C-N 127.324 2.89 . . . . 0.0 111.671 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -149.74 -53.55 0.16 Allowed 'General case' 0 C--N 1.327 -0.388 0 O-C-N 124.472 1.107 . . . . 0.0 110.459 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -166.95 119.91 0.98 Allowed 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.91 0.862 . . . . 0.0 110.69 -178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 20.4 ptt? -115.64 133.53 55.94 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.358 -0.839 . . . . 0.0 110.785 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -178.33 170.51 1.72 Allowed 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.0 p 172.0 137.88 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 123.546 0.529 . . . . 0.0 109.873 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -166.53 131.13 2.13 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -157.42 85.88 0.13 Allowed Glycine 0 C--O 1.222 -0.638 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.33 149.66 38.1 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.461 -0.199 . . . . 0.0 110.461 178.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.05 162.26 0.31 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.983 0.897 . . . . 0.0 110.375 179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -81.81 117.88 22.45 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.396 179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 79.46 100.44 0.26 Allowed Glycine 0 C--N 1.337 0.615 0 N-CA-C 110.304 -1.118 . . . . 0.0 110.304 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -108.46 72.36 0.83 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.093 0.473 . . . . 0.0 109.868 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.44 ' CB ' ' HG3' ' A' ' 80' ' ' GLU . 19.2 p -62.81 144.1 56.89 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.589 179.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -154.19 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.609 0 O-C-N 125.91 2.006 . . . . 0.0 110.432 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -46.04 62.08 Favored 'General case' 0 N--CA 1.445 -0.675 0 O-C-N 118.846 -2.409 . . . . 0.0 110.707 178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -177.42 45.39 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 123.703 0.627 . . . . 0.0 109.926 178.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.18 -35.8 81.5 Favored 'General case' 0 CA--C 1.481 -1.677 0 CA-C-O 115.314 -2.279 . . . . 0.0 108.326 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HB2' ' CE2' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -32.85 -54.66 0.37 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 126.293 1.837 . . . . 0.0 112.628 175.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -66.92 0.43 Allowed 'General case' 0 N--CA 1.439 -1.019 0 CA-C-O 121.337 0.589 . . . . 0.0 110.26 177.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.501 ' HA ' ' CD ' ' A' ' 24' ' ' ARG . 5.4 mt-10 -53.82 -13.19 0.66 Allowed 'General case' 0 C--O 1.208 -1.101 0 O-C-N 120.297 -1.502 . . . . 0.0 113.095 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.684 HG22 ' CB ' ' A' ' 26' ' ' ASP . 0.9 OUTLIER -85.8 -37.31 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 C-N-CA 126.566 1.946 . . . . 0.0 107.691 179.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.517 ' HB3' ' CE1' ' A' ' 84' ' ' TYR . 1.0 OUTLIER -78.87 40.87 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 124.167 1.937 . . . . 0.0 110.404 -179.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.501 ' CD ' ' HA ' ' A' ' 21' ' ' GLU . 13.2 ptp180 -152.89 -42.58 0.1 Allowed 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 118.277 -2.764 . . . . 0.0 109.867 -178.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.08 -57.07 1.8 Allowed 'General case' 0 C--O 1.208 -1.11 0 O-C-N 124.83 1.331 . . . . 0.0 108.689 -177.209 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.684 ' CB ' HG22 ' A' ' 22' ' ' VAL . 1.1 m-20 -58.98 -177.16 0.03 OUTLIER 'General case' 0 CA--C 1.487 -1.455 0 O-C-N 120.412 -1.43 . . . . 0.0 108.907 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.622 HD21 ' HD3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -40.99 93.9 0.01 OUTLIER 'General case' 0 C--O 1.212 -0.889 0 C-N-CA 124.443 1.097 . . . . 0.0 110.542 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 t -150.68 34.05 0.62 Allowed 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -169.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.16 -32.49 0.01 OUTLIER 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 117.717 -1.135 . . . . 0.0 109.43 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.461 ' SG ' HD12 ' A' ' 27' ' ' LEU . 38.3 m -48.62 -52.63 22.11 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 119.927 1.239 . . . . 0.0 109.833 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.609 ' OE1' HD11 ' A' ' 34' ' ' LEU . 0.3 OUTLIER -73.04 -31.96 64.77 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-O 126.138 2.875 . . . . 0.0 110.562 177.037 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.1 ttm-85 -60.44 -34.28 73.76 Favored 'General case' 0 C--O 1.196 -1.713 1 O-C-N 116.077 -4.139 . . . . 0.0 110.619 175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.45 ' CD2' HD11 ' A' ' 110' ' ' ILE . 74.7 t80 -57.45 -53.19 60.93 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 126.717 2.007 . . . . 0.0 109.998 -179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.76 HD13 ' HG2' ' A' ' 106' ' ' ARG . 4.3 pp -74.95 -23.23 58.27 Favored 'General case' 0 N--CA 1.445 -0.691 0 O-C-N 124.77 1.294 . . . . 0.0 109.834 178.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -44.7 63.82 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.79 -165.58 0.75 Allowed 'General case' 0 N--CA 1.437 -1.124 0 C-N-CA 124.185 0.994 . . . . 0.0 110.24 -178.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.6 t -85.76 -71.44 0.54 Allowed 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.157 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 158.61 89.76 0.0 OUTLIER 'General case' 0 C--N 1.344 0.351 0 CA-C-O 122.196 0.998 . . . . 0.0 110.025 -177.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 m -163.1 -175.17 4.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.749 0.785 . . . . 0.0 109.51 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.92 88.03 0.88 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.511 178.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -38.81 109.68 0.11 Allowed 'General case' 0 CA--C 1.529 0.166 0 O-C-N 124.734 1.271 . . . . 0.0 111.549 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.7 m -87.67 89.8 8.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -177.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.526 ' H ' HD22 ' A' ' 48' ' ' LEU . 3.7 m -93.06 -139.68 0.2 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.832 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.524 ' H ' HG22 ' A' ' 43' ' ' THR . . . -91.84 -115.15 2.05 Favored Glycine 0 C--O 1.219 -0.837 0 CA-C-O 122.722 1.179 . . . . 0.0 112.423 177.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -86.68 24.89 1.35 Allowed 'General case' 0 C--N 1.319 -0.747 0 O-C-N 120.341 -1.682 . . . . 0.0 111.0 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -75.51 -148.73 0.03 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 120.477 -1.389 . . . . 0.0 110.939 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.463 ' O ' HG12 ' A' ' 47' ' ' VAL . 61.2 t -78.92 56.74 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-O 123.562 1.648 . . . . 0.0 108.882 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.526 HD22 ' H ' ' A' ' 43' ' ' THR . 0.6 OUTLIER -140.29 37.36 1.9 Allowed 'General case' 0 N--CA 1.445 -0.692 0 O-C-N 119.716 -1.865 . . . . 0.0 108.959 179.385 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -57.5 170.33 0.55 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 mtt -174.76 86.44 0.33 Allowed Pre-proline 0 C--N 1.327 -0.385 0 O-C-N 124.102 0.877 . . . . 0.0 111.1 178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -71.33 -20.09 28.25 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.527 1.484 . . . . 0.0 112.971 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -136.51 -78.54 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.425 0 CA-C-O 116.336 -2.369 . . . . 0.0 110.821 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -167.4 -81.01 0.02 OUTLIER 'General case' 0 C--O 1.236 0.346 0 O-C-N 126.134 1.726 . . . . 0.0 109.494 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -75.95 62.32 1.6 Allowed 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.471 ' ND2' ' HA ' ' A' ' 61' ' ' GLN . 7.5 p30 36.97 -158.53 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 123.326 1.536 . . . . 0.0 111.236 -177.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -110.26 66.95 0.63 Allowed 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 171.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.7 tp60 -159.95 163.43 34.21 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -46.86 -57.69 4.67 Favored 'General case' 0 N--CA 1.45 -0.461 0 O-C-N 124.173 0.92 . . . . 0.0 110.718 -179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -169.84 83.44 0.12 Allowed 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.246 1.022 . . . . 0.0 109.862 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 176.95 94.52 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 122.23 1.014 . . . . 0.0 109.438 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.471 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 2.2 pt20 -66.16 -30.33 70.79 Favored 'General case' 0 CA--C 1.52 -0.175 0 O-C-N 121.539 -0.725 . . . . 0.0 111.074 178.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.08 -54.5 7.71 Favored 'General case' 0 CA--C 1.494 -1.186 0 CA-C-O 118.276 -0.869 . . . . 0.0 109.96 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.729 ' CD2' HG23 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -52.11 -27.56 14.55 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.368 0.986 . . . . 0.0 110.26 178.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.16 -40.46 70.66 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 122.45 1.119 . . . . 0.0 109.183 175.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -37.39 74.43 Favored 'General case' 0 C--O 1.197 -1.686 0 O-C-N 118.568 -2.583 . . . . 0.0 108.439 -178.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.836 ' O ' HG23 ' A' ' 70' ' ' VAL . 9.5 t -70.85 -49.84 41.78 Favored 'General case' 0 C--O 1.194 -1.839 0 CA-C-N 120.281 1.4 . . . . 0.0 107.956 177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.3 t -57.28 -51.92 67.42 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-N 121.461 1.937 . . . . 0.0 110.015 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -59.67 -29.9 68.39 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 123.519 0.727 . . . . 0.0 110.05 177.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -74.23 -47.21 36.79 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-O 123.678 1.704 . . . . 0.0 110.961 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.836 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.9 t -72.64 -17.72 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.825 0 O-C-N 117.666 -3.146 . . . . 0.0 107.679 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -74.28 -23.77 59.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 O-C-N 121.557 -0.715 . . . . 0.0 109.408 177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.435 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 2.0 mt-30 -98.13 17.14 19.19 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.893 -0.575 . . . . 0.0 110.567 177.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.5 OUTLIER -69.97 165.6 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 118.721 0.691 . . . . 0.0 110.241 178.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -69.87 -80.08 0.05 Allowed 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 118.168 -0.92 . . . . 0.0 109.921 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 168.29 -24.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 O-C-N 125.623 1.827 . . . . 0.0 109.917 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -128.49 -3.92 5.42 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.234 -1.541 . . . . 0.0 107.615 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 10.2 m -96.01 1.91 53.03 Favored 'General case' 0 C--O 1.186 -2.281 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.456 ' HG2' ' NH1' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -52.22 -49.05 64.72 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 122.847 2.567 . . . . 0.0 108.915 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' A' ' 123' ' ' ARG . 0.0 OUTLIER -71.48 -68.93 0.41 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 119.993 -1.692 . . . . 0.0 109.266 -179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.44 ' HG3' ' CB ' ' A' ' 14' ' ' SER . 2.0 tm-20 -42.46 -31.77 0.46 Allowed 'General case' 0 C--O 1.214 -0.768 0 O-C-N 125.027 1.454 . . . . 0.0 111.919 178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.611 ' HB3' HD22 ' A' ' 27' ' ' LEU . . . -53.35 -53.28 53.37 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 125.063 1.345 . . . . 0.0 109.993 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.38 -34.73 49.72 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.846 0 O-C-N 120.511 -1.368 . . . . 0.0 109.602 176.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.19 -6.85 19.72 Favored 'General case' 0 C--O 1.214 -0.805 0 CA-C-N 118.038 0.381 . . . . 0.0 110.068 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 23' ' ' GLN . 18.8 t80 -102.36 -62.31 1.28 Allowed 'General case' 0 N--CA 1.432 -1.33 0 C-N-CA 124.403 1.081 . . . . 0.0 108.971 -179.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -67.34 -54.73 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.961 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 -176.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -74.56 52.21 0.49 Allowed 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 -177.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -171.32 -52.48 0.02 OUTLIER 'General case' 0 N--CA 1.435 -1.22 0 C-N-CA 124.325 1.05 . . . . 0.0 111.506 176.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.94 -48.89 77.24 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.536 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -71.52 -24.52 61.98 Favored 'General case' 0 C--O 1.2 -1.515 0 CA-C-O 117.022 -1.466 . . . . 0.0 109.355 178.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.598 ' HA ' HD23 ' A' ' 95' ' ' LEU . 13.3 mt -65.41 -48.57 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.987 1.721 . . . . 0.0 109.782 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 3.3 mm-40 -73.79 -32.69 63.88 Favored 'General case' 0 N--CA 1.447 -0.585 0 O-C-N 122.271 -0.268 . . . . 0.0 110.391 178.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -73.97 -55.32 6.29 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 122.242 1.02 . . . . 0.0 109.295 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.512 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -70.25 -179.45 26.36 Favored Glycine 0 N--CA 1.434 -1.451 0 O-C-N 120.286 -1.509 . . . . 0.0 111.118 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.15 41.03 0.85 Allowed 'General case' 0 C--O 1.204 -1.308 0 O-C-N 121.366 -1.079 . . . . 0.0 111.406 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.628 HD22 ' N ' ' A' ' 95' ' ' LEU . 0.3 OUTLIER -93.48 37.45 1.06 Allowed 'General case' 0 C--N 1.318 -0.803 0 O-C-N 119.858 -1.776 . . . . 0.0 108.393 -178.223 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.412 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 0.1 OUTLIER -142.13 157.82 44.45 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.061 0.945 . . . . 0.0 110.02 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 107.65 -28.27 12.88 Favored Glycine 0 C--O 1.217 -0.956 0 CA-C-O 117.663 -1.631 . . . . 0.0 111.694 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 169.24 -30.54 0.0 OUTLIER 'General case' 0 N--CA 1.457 -0.102 0 O-C-N 124.877 0.986 . . . . 0.0 110.029 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -88.36 26.09 1.51 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.82 0.819 . . . . 0.0 109.829 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.2 p -86.34 -36.15 19.41 Favored 'General case' 0 N--CA 1.445 -0.677 0 O-C-N 120.896 -1.127 . . . . 0.0 110.794 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -75.31 -26.85 59.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.446 0.641 . . . . 0.0 109.836 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.22 -27.19 65.26 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 117.951 -1.023 . . . . 0.0 109.934 177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.61 HG21 HD12 ' A' ' 95' ' ' LEU . 2.9 t -80.87 -24.14 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 O-C-N 124.028 0.83 . . . . 0.0 108.815 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.76 -49.02 57.06 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 120.856 -1.152 . . . . 0.0 109.277 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -71.79 -29.56 64.59 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.029 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.76 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -54.91 -56.83 15.28 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.736 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -54.58 -34.0 61.23 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 117.771 -1.109 . . . . 0.0 108.742 -177.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -45.82 -39.71 8.76 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 124.094 0.854 . . . . 0.0 112.005 175.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -51.23 -61.61 2.13 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 118.745 1.273 . . . . 0.0 111.263 177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.729 HG23 ' CD2' ' A' ' 63' ' ' LEU . 3.2 mm -68.04 -31.28 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.828 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -178.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.872 HG21 ' CB ' ' A' ' 119' ' ' MET . 65.1 t -56.98 -59.24 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.136 0 CA-C-O 118.329 -0.843 . . . . 0.0 109.069 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 40.8 m -55.85 -21.61 20.82 Favored 'General case' 0 N--CA 1.445 -0.723 0 C-N-CA 123.642 0.777 . . . . 0.0 110.072 178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.41 ' OG ' HD13 ' A' ' 63' ' ' LEU . 1.2 t -77.21 -71.42 0.41 Allowed 'General case' 0 N--CA 1.434 -1.267 0 O-C-N 123.555 0.534 . . . . 0.0 110.505 177.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.581 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.7 t -154.65 39.37 0.44 Allowed 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -135.74 30.04 2.8 Favored Glycine 0 C--O 1.219 -0.794 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.663 ' HA ' HG13 ' A' ' 111' ' ' VAL . 3.3 t -71.81 101.52 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.775 0 CA-C-N 118.03 0.915 . . . . 0.0 110.41 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.622 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -145.33 -91.01 0.1 Allowed 'General case' 0 C--O 1.191 -2.005 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.289 -179.45 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.56 -2.6 44.66 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.103 0.865 . . . . 0.0 109.608 176.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.872 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.37 0.88 48.65 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.571 0.544 . . . . 0.0 111.678 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.06 -77.66 0.11 Allowed 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.538 ' CD ' HG12 ' A' ' 116' ' ' VAL . 13.1 pt20 -79.54 -159.06 0.18 Allowed 'General case' 0 N--CA 1.443 -0.804 0 CA-C-O 122.215 1.007 . . . . 0.0 110.06 -177.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.587 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -94.61 -153.79 0.4 Allowed 'General case' 0 N--CA 1.441 -0.88 0 CA-C-O 123.549 1.642 . . . . 0.0 109.888 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.587 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -67.07 -29.43 69.21 Favored 'General case' 0 C--O 1.209 -1.058 0 O-C-N 119.866 -1.771 . . . . 0.0 111.391 178.198 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 10.2 t -139.95 122.02 15.73 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.248 -0.882 . . . . 0.0 109.852 -177.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.7 t30 . . . . . 0 C--O 1.254 1.306 0 O-C-N 125.525 1.766 . . . . 0.0 111.924 177.822 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.62 0 CA-C-O 117.738 -1.125 . . . . 0.0 108.409 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -160.11 -50.76 0.05 Allowed 'General case' 0 C--N 1.324 -0.527 0 O-C-N 125.27 1.606 . . . . 0.0 109.793 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -158.37 -178.96 7.67 Favored 'General case' 0 CA--C 1.509 -0.598 0 O-C-N 120.989 -1.069 . . . . 0.0 109.12 -177.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -39.91 102.89 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 124.603 1.161 . . . . 0.0 111.708 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 175.79 158.55 0.24 Allowed 'General case' 0 C--O 1.237 0.427 0 O-C-N 124.116 0.885 . . . . 0.0 109.863 -176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 173.2 111.41 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.719 0.808 . . . . 0.0 109.897 -178.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.31 119.49 11.45 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.69 -92.16 0.01 OUTLIER Glycine 0 CA--C 1.531 1.056 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.28 132.42 47.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 122.143 0.973 . . . . 0.0 110.235 178.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.93 162.41 6.99 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.809 177.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -144.15 178.96 7.52 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.514 177.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.39 92.27 0.02 OUTLIER Glycine 0 CA--C 1.522 0.53 0 C-N-CA 123.976 0.798 . . . . 0.0 111.522 177.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -90.21 54.6 2.82 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.4 p -163.53 149.15 11.32 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.8 t -59.77 -164.82 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 O-C-N 124.178 0.924 . . . . 0.0 110.587 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -39.56 -47.08 1.86 Allowed 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -175.6 44.78 0.01 OUTLIER 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.78 1.276 . . . . 0.0 110.352 175.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -68.9 -55.45 10.99 Favored 'General case' 0 CA--C 1.5 -0.958 0 CA-C-O 115.934 -1.984 . . . . 0.0 106.755 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' HG2' ' CD1' ' A' ' 84' ' ' TYR . 9.6 ttt85 -41.75 -31.08 0.27 Allowed 'General case' 0 C--O 1.214 -0.811 0 O-C-N 125.514 1.759 . . . . 0.0 113.035 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -67.17 -79.75 0.05 OUTLIER 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 113.657 -1.61 . . . . 0.0 111.223 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.08 -26.82 51.12 Favored 'General case' 0 C--O 1.216 -0.696 0 O-C-N 119.63 -1.919 . . . . 0.0 112.653 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.654 HG22 ' CG ' ' A' ' 26' ' ' ASP . 4.9 t -58.32 -37.69 64.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 125.411 1.484 . . . . 0.0 111.128 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.37 -4.21 13.81 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 175.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 74.2 mtm180 -139.63 15.16 2.53 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 125.189 1.396 . . . . 0.0 111.724 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.08 -67.2 0.46 Allowed 'General case' 0 CA--C 1.506 -0.72 0 C-N-CA 124.236 1.014 . . . . 0.0 109.739 -176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.654 ' CG ' HG22 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -75.76 175.14 8.97 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.3 mm? -7.94 86.42 0.0 OUTLIER 'General case' 0 C--O 1.195 -1.783 0 C-N-CA 126.199 1.799 . . . . 0.0 110.447 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.1 p -129.39 26.45 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 123.08 1.419 . . . . 0.0 108.667 -172.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.9 -30.71 0.01 OUTLIER 'General case' 0 C--O 1.205 -1.272 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.819 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' HB3' HG21 ' A' ' 110' ' ' ILE . 5.1 m -55.74 -66.1 0.48 Allowed 'General case' 0 C--O 1.212 -0.906 0 CA-C-O 120.907 0.384 . . . . 0.0 111.34 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.663 ' OE2' HD11 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -55.75 -43.57 76.79 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 122.575 1.178 . . . . 0.0 110.551 174.509 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.67 -29.53 39.15 Favored 'General case' 0 C--O 1.22 -0.447 0 O-C-N 120.657 -1.277 . . . . 0.0 113.709 177.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.517 ' CE1' ' HB3' ' A' ' 38' ' ' SER . 23.4 t80 -56.4 -57.61 11.54 Favored 'General case' 0 C--O 1.212 -0.901 0 C-N-CA 126.279 1.831 . . . . 0.0 110.273 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD11 ' OE2' ' A' ' 31' ' ' GLU . 4.2 pp -74.45 -19.98 60.19 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.95 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -1.1 54.94 Favored 'General case' 0 C--O 1.244 0.784 0 CA-C-O 119.079 -0.486 . . . . 0.0 112.123 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -154.74 -162.99 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.507 1.123 . . . . 0.0 110.96 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.5 m -86.28 -179.63 6.73 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 122.396 1.093 . . . . 0.0 110.466 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.517 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 7.5 p -125.15 115.46 20.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.377 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.7 t -165.22 132.68 3.02 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.99 144.63 52.96 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 176.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -172.07 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.367 0 O-C-N 124.143 0.902 . . . . 0.0 111.945 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 85.2 p -60.92 76.17 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.896 1.331 . . . . 0.0 113.68 175.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 p -142.82 140.69 31.42 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 120.1 -1.625 . . . . 0.0 107.782 -173.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.15 -114.22 0.05 OUTLIER Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -149.84 49.51 0.93 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 122.372 1.082 . . . . 0.0 110.432 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -140.19 35.63 1.9 Allowed 'General case' 0 C--O 1.224 -0.283 0 CA-C-O 123.141 1.448 . . . . 0.0 109.895 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.495 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -88.08 28.39 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.334 0 O-C-N 120.602 -1.311 . . . . 0.0 110.0 178.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.41 -16.24 22.03 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 121.956 0.884 . . . . 0.0 111.207 179.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.88 137.23 38.26 Favored 'General case' 0 N--CA 1.447 -0.597 0 O-C-N 121.333 -0.855 . . . . 0.0 111.079 175.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 171.86 6.71 Favored Pre-proline 0 C--O 1.238 0.46 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.933 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -74.06 54.16 3.1 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.953 3.102 . . . . 0.0 112.192 176.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.41 -91.82 0.12 Allowed Glycine 0 C--O 1.221 -0.684 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.02 -55.26 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 124.994 1.055 . . . . 0.0 109.15 -178.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -105.53 106.95 17.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -113.8 27.39 9.57 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 111.043 175.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.86 -178.03 3.53 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 123.601 0.76 . . . . 0.0 109.621 -178.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.5 tp60 -165.59 -69.86 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.404 0.621 . . . . 0.0 110.576 176.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.9 tp60 -122.13 177.66 5.25 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 123.435 0.694 . . . . 0.0 110.321 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -58.72 87.27 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.593 0.757 . . . . 0.0 111.643 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.46 ' CB ' HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER 169.87 76.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 124.454 1.102 . . . . 0.0 108.304 -175.291 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -55.8 -26.74 47.66 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.669 -0.645 . . . . 0.0 110.817 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.0 OUTLIER -63.99 -40.55 96.63 Favored 'General case' 0 C--O 1.211 -0.939 0 O-C-N 121.329 -0.857 . . . . 0.0 112.195 178.4 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.747 HD11 HD12 ' A' ' 110' ' ' ILE . 1.5 mp -50.55 -22.66 2.07 Favored 'General case' 0 N--CA 1.473 0.69 0 O-C-N 121.339 -0.851 . . . . 0.0 112.706 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -47.61 -31.01 4.09 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 169.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.65 -36.4 73.39 Favored 'General case' 0 CA--C 1.508 -0.661 0 C-N-CA 124.455 1.102 . . . . 0.0 110.015 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' O ' HG23 ' A' ' 70' ' ' VAL . 18.9 t -72.42 -49.34 34.37 Favored 'General case' 0 C--O 1.203 -1.39 0 O-C-N 123.975 0.797 . . . . 0.0 109.038 175.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -58.09 -49.82 75.62 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.886 178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -59.92 -24.33 64.25 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.0 mm-40 -80.56 -53.39 6.6 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 123.865 0.866 . . . . 0.0 111.33 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.806 HG22 HD13 ' A' ' 27' ' ' LEU . 10.1 t -65.0 -12.71 13.74 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.245 0 C-N-CA 124.018 0.927 . . . . 0.0 110.604 175.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.0 tptt -74.5 -25.06 59.12 Favored 'General case' 0 C--O 1.225 -0.233 0 O-C-N 121.422 -0.799 . . . . 0.0 110.944 174.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -96.44 15.79 20.39 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-O 118.44 -0.791 . . . . 0.0 111.307 175.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.434 HG23 ' CB ' ' A' ' 26' ' ' ASP . 0.3 OUTLIER -67.44 174.24 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.104 0 CA-C-O 121.45 0.643 . . . . 0.0 111.022 177.517 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -71.14 -66.02 0.67 Allowed 'General case' 0 C--O 1.219 -0.539 0 CA-C-O 117.625 -1.179 . . . . 0.0 109.674 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 p30 157.9 -43.93 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 O-C-N 125.636 1.835 . . . . 0.0 111.84 -170.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.412 ' HB3' ' CB ' ' A' ' 125' ' ' ASN . 12.0 pt-20 -132.5 1.07 3.71 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.43 1.092 . . . . 0.0 111.439 -178.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -90.34 -6.19 55.36 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.976 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 0.0 OUTLIER -59.26 -42.53 91.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.535 0.683 . . . . 0.0 110.17 178.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -64.08 -67.81 0.4 Allowed 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.621 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.51 -39.28 0.45 Allowed 'General case' 0 C--N 1.346 0.447 0 O-C-N 125.544 1.777 . . . . 0.0 111.353 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.663 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -50.06 -58.67 5.02 Favored 'General case' 0 C--O 1.201 -1.461 0 O-C-N 123.423 0.452 . . . . 0.0 111.91 176.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.745 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 0.6 OUTLIER -57.34 -38.24 61.36 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 CA-C-O 121.661 0.744 . . . . 0.0 112.055 171.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.452 ' HD2' HG22 ' A' ' 82' ' ' ILE . 18.4 mmmt -66.62 -6.31 14.88 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.413 -0.805 . . . . 0.0 110.807 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.53 ' CD1' ' HG2' ' A' ' 19' ' ' ARG . 8.9 t80 -114.52 -64.24 1.34 Allowed 'General case' 0 C--O 1.19 -2.04 0 C-N-CA 127.671 2.388 . . . . 0.0 109.177 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 27' ' ' LEU . 15.1 tt -72.07 -49.98 40.22 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 C-N-CA 124.591 1.156 . . . . 0.0 109.412 -175.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.745 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -60.13 -48.7 80.61 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 90' ' ' ILE . 6.4 tt0 -67.94 -32.05 72.22 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.099 0.476 . . . . 0.0 111.638 177.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.45 -65.46 0.68 Allowed 'General case' 0 CA--C 1.497 -1.075 0 C-N-CA 124.695 1.198 . . . . 0.0 107.876 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.585 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -52.49 -31.12 33.59 Favored 'General case' 0 C--O 1.208 -1.119 0 CA-C-O 115.981 -1.961 . . . . 0.0 110.81 174.894 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.734 HG13 HG11 ' A' ' 103' ' ' VAL . 19.2 mt -64.56 -44.33 96.81 Favored 'Isoleucine or valine' 0 C--N 1.35 0.628 0 O-C-N 124.795 1.309 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -78.05 -28.23 48.86 Favored 'General case' 0 C--N 1.321 -0.643 0 O-C-N 121.22 -0.925 . . . . 0.0 112.275 176.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -56.9 4.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 121.848 0.832 . . . . 0.0 109.957 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.494 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -71.93 -175.46 24.52 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-O 123.722 1.735 . . . . 0.0 111.067 177.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -85.64 46.2 1.28 Allowed 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.241 -1.152 . . . . 0.0 109.804 178.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.796 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -95.48 18.77 12.03 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.266 -1.521 . . . . 0.0 108.682 179.096 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.7 m170 -95.64 -179.21 4.66 Favored 'General case' 0 C--O 1.211 -0.925 0 C-N-CA 123.624 0.77 . . . . 0.0 110.863 177.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 79.35 -65.66 3.59 Favored Glycine 0 C--O 1.226 -0.374 0 CA-C-O 118.061 -1.411 . . . . 0.0 109.637 -178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 179.45 46.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 123.663 1.697 . . . . 0.0 112.423 -179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.2 8.69 2.71 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 120.592 -1.317 . . . . 0.0 109.813 -176.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.65 -39.69 70.16 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.06 -25.91 65.75 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.859 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.7 mtp85 -69.3 -32.12 71.06 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 118.451 -0.785 . . . . 0.0 111.37 177.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.796 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.5 t -78.88 -39.81 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.288 0 O-C-N 123.854 0.721 . . . . 0.0 110.472 176.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.7 -47.66 81.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.041 0.448 . . . . 0.0 109.947 178.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -69.97 -30.48 67.84 Favored 'General case' 0 C--O 1.226 -0.151 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.086 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.618 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -62.1 -58.58 7.29 Favored 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 122.901 0.48 . . . . 0.0 109.743 -179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.769 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -50.74 -35.95 34.11 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 117.783 -1.103 . . . . 0.0 109.216 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -45.14 -34.85 4.53 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 126.074 1.797 . . . . 0.0 113.04 174.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -55.48 -62.27 1.79 Allowed 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.134 0.968 . . . . 0.0 110.381 176.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.747 HD12 HD11 ' A' ' 63' ' ' LEU . 2.8 mm -68.38 -27.04 35.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.672 0 CA-C-O 121.912 0.863 . . . . 0.0 110.711 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.813 HG21 ' CB ' ' A' ' 119' ' ' MET . 77.5 t -57.66 -54.77 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.374 177.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 52.9 p -56.0 -30.05 61.25 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 124.406 1.067 . . . . 0.0 111.658 177.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.477 ' CB ' HD23 ' A' ' 63' ' ' LEU . 3.9 m -68.0 -71.44 0.21 Allowed 'General case' 0 C--O 1.22 -0.452 0 O-C-N 123.893 0.746 . . . . 0.0 110.291 178.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.9 t -159.51 34.54 0.19 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 123.377 1.561 . . . . 0.0 109.508 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.553 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -125.02 36.58 2.79 Favored Glycine 0 C--O 1.216 -0.972 0 N-CA-C 109.371 -1.492 . . . . 0.0 109.371 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.727 HG23 ' HB3' ' A' ' 120' ' ' ARG . 2.4 p -70.72 76.4 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 119.147 1.474 . . . . 0.0 110.909 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -98.83 -79.98 0.47 Allowed 'General case' 0 CA--C 1.497 -1.08 0 CA-C-O 122.52 1.152 . . . . 0.0 108.535 -173.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -123.13 -0.92 8.82 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 113.147 -1.842 . . . . 0.0 111.071 175.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.813 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.45 8.49 44.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.846 0.355 . . . . 0.0 111.751 178.734 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.727 ' HB3' HG23 ' A' ' 116' ' ' VAL . 1.9 ttt180 -158.48 -45.33 0.06 Allowed 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 123.637 0.775 . . . . 0.0 111.116 178.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.567 ' HB2' HG22 ' A' ' 116' ' ' VAL . 2.7 mm-40 -92.32 -170.06 2.4 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.708 ' O ' HG23 ' A' ' 124' ' ' THR . 7.1 p -154.84 -178.44 7.21 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 125.12 1.368 . . . . 0.0 109.171 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -44.62 100.38 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.465 0.706 . . . . 0.0 112.091 -179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.708 HG23 ' O ' ' A' ' 122' ' ' THR . 11.9 p -118.28 -86.06 0.64 Allowed 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 116.227 -1.844 . . . . 0.0 107.032 -171.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.412 ' CB ' ' HB3' ' A' ' 76' ' ' GLU . 57.1 t30 . . . . . 0 CA--C 1.541 0.598 0 O-C-N 126.093 2.12 . . . . 0.0 111.129 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.86 -62.93 1.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.364 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.2 132.04 52.67 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.205 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.1 ttt -74.25 55.26 0.59 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-O 121.742 0.782 . . . . 0.0 111.24 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -136.52 168.26 19.82 Favored 'General case' 0 N--CA 1.434 -1.261 0 O-C-N 121.518 -0.739 . . . . 0.0 110.029 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 170.12 105.04 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.785 0.802 . . . . 0.0 109.63 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -148.27 35.27 0.81 Allowed 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.898 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -59.22 -83.12 0.06 OUTLIER Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.086 -0.806 . . . . 0.0 111.086 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -147.2 129.68 15.86 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.641 0.734 . . . . 0.0 110.347 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -159.7 165.01 33.46 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.266 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.95 71.74 6.67 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 122.036 0.922 . . . . 0.0 110.046 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -99.92 41.03 2.26 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.9 t -87.98 -59.81 2.14 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.505 0.669 . . . . 0.0 109.831 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 19' ' ' ARG . 12.1 p -168.73 169.08 10.28 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.374 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -58.5 173.42 0.39 Allowed 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 -177.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -44.88 -49.41 10.95 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.316 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.454 ' O ' ' CG ' ' A' ' 20' ' ' GLN . 3.4 tt0 -175.04 34.3 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.032 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.494 ' HB3' HG23 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -79.46 -22.41 44.15 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-O 116.526 -1.702 . . . . 0.0 106.952 179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 14' ' ' SER . 0.2 OUTLIER -38.76 -45.73 1.17 Allowed 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 121.553 1.978 . . . . 0.0 110.45 179.202 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.454 ' CG ' ' O ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -52.34 -78.51 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.711 0.767 . . . . 0.0 110.759 177.381 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -55.67 -27.74 51.73 Favored 'General case' 0 C--O 1.206 -1.228 0 O-C-N 120.398 -1.439 . . . . 0.0 111.643 178.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.563 HG12 ' CD2' ' A' ' 84' ' ' TYR . 2.5 t -62.84 -43.71 99.04 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.691 0 C-N-CA 126.017 1.727 . . . . 0.0 107.548 179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -78.99 36.09 0.27 Allowed 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 124.256 1.022 . . . . 0.0 111.573 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 -153.71 -45.39 0.09 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 122.954 0.502 . . . . 0.0 110.456 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.28 -79.89 0.58 Allowed 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -177.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.69 ' CB ' HG23 ' A' ' 73' ' ' VAL . 0.1 OUTLIER -38.0 147.09 0.05 OUTLIER 'General case' 0 CA--C 1.484 -1.592 0 CA-C-O 114.355 -2.736 . . . . 0.0 109.6 179.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.907 HD21 ' HD3' ' A' ' 117' ' ' ARG . 3.2 mm? -6.98 81.85 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.612 0 O-C-N 126.842 2.589 . . . . 0.0 112.48 -178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -138.67 38.11 2.21 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 123.158 1.456 . . . . 0.0 107.344 -170.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.05 -34.69 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.97 0 O-C-N 120.33 -1.481 . . . . 0.0 109.382 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.443 ' HB3' ' CG2' ' A' ' 110' ' ' ILE . 39.3 m -52.84 -52.99 55.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 118.789 0.722 . . . . 0.0 109.143 179.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.825 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -73.03 -32.49 65.12 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 122.008 0.909 . . . . 0.0 109.471 179.651 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -63.09 -39.09 93.68 Favored 'General case' 0 C--O 1.203 -1.391 0 O-C-N 120.916 -1.115 . . . . 0.0 110.049 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.553 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 47.5 t80 -51.81 -44.83 63.67 Favored 'General case' 0 N--CA 1.432 -1.354 0 C-N-CA 125.195 1.398 . . . . 0.0 110.489 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.694 HD13 ' HB3' ' A' ' 106' ' ' ARG . 0.6 OUTLIER -74.91 -28.7 60.72 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 124.15 0.906 . . . . 0.0 109.454 179.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -68.36 -46.29 70.52 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -79.89 -166.76 1.07 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.007 0.523 . . . . 0.0 110.798 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -87.12 -53.35 4.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.423 179.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -166.16 98.24 0.62 Allowed 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.0 m -38.93 102.46 0.02 OUTLIER 'General case' 0 C--O 1.209 -1.048 0 O-C-N 123.921 0.763 . . . . 0.0 111.328 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.52 123.75 0.67 Allowed 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 120.873 -1.142 . . . . 0.0 109.728 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 178.91 138.31 0.09 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.573 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.405 ' HA ' HD13 ' A' ' 48' ' ' LEU . 1.7 m -88.96 93.44 9.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.921 0.763 . . . . 0.0 110.269 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.62 ' OG1' HD22 ' A' ' 48' ' ' LEU . 71.4 p -93.17 -138.56 0.2 Allowed 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.565 -179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.741 ' O ' HD21 ' A' ' 48' ' ' LEU . . . -94.0 -122.74 3.57 Favored Glycine 0 N--CA 1.438 -1.191 0 CA-C-O 121.903 0.724 . . . . 0.0 111.922 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -86.38 27.28 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.712 0.768 . . . . 0.0 110.761 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.32 -147.64 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.177 0 CA-C-O 123.105 1.431 . . . . 0.0 110.936 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.631 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -89.47 36.64 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 O-C-N 120.493 -1.38 . . . . 0.0 109.795 178.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.741 HD21 ' O ' ' A' ' 44' ' ' GLY . 0.8 OUTLIER -110.21 13.89 22.95 Favored 'General case' 0 N--CA 1.444 -0.728 0 O-C-N 120.356 -1.465 . . . . 0.0 109.822 179.349 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -98.87 28.35 4.39 Favored 'General case' 0 N--CA 1.443 -0.775 0 C-N-CA 122.835 0.454 . . . . 0.0 110.575 179.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 mtt -165.39 80.27 1.2 Allowed Pre-proline 0 N--CA 1.444 -0.772 0 CA-C-O 121.274 0.559 . . . . 0.0 110.937 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -71.78 54.41 2.04 Favored 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 122.543 2.162 . . . . 0.0 112.775 178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.39 110.12 2.41 Favored Glycine 0 N--CA 1.441 -0.994 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -172.12 -64.44 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.504 0.669 . . . . 0.0 109.538 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -109.86 104.25 13.16 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 122.28 1.038 . . . . 0.0 108.409 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -179.04 175.05 1.01 Allowed 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.436 178.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.19 138.4 2.23 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 124.002 0.814 . . . . 0.0 110.836 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -66.81 71.88 0.09 Allowed 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 123.924 0.765 . . . . 0.0 109.977 -179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -179.14 126.72 0.09 Allowed 'General case' 0 N--CA 1.426 -1.642 0 C-N-CA 123.454 0.702 . . . . 0.0 110.051 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -45.37 107.57 0.1 Allowed 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.522 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 89.3 p -174.77 68.44 0.02 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 122.036 0.922 . . . . 0.0 108.815 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -61.9 -14.02 30.29 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.847 -0.533 . . . . 0.0 110.064 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.9 mm100 -71.08 -64.25 0.94 Allowed 'General case' 0 N--CA 1.432 -1.339 0 O-C-N 122.064 -0.398 . . . . 0.0 110.358 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.77 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.8 mp -58.98 -26.12 64.21 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -51.75 -30.56 23.11 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 122.899 0.48 . . . . 0.0 110.177 177.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.408 ' O ' ' CG ' ' A' ' 69' ' ' GLN . 23.9 mt-30 -70.27 -29.85 66.73 Favored 'General case' 0 C--O 1.2 -1.504 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 178.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.643 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.8 OUTLIER -73.93 -51.01 17.45 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 124.535 1.134 . . . . 0.0 108.819 177.244 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.6 t -57.5 -50.7 72.22 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 118.832 0.742 . . . . 0.0 109.15 179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -62.71 -23.21 67.04 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.408 ' CG ' ' O ' ' A' ' 65' ' ' GLN . 2.5 mm100 -78.77 -47.8 16.06 Favored 'General case' 0 N--CA 1.438 -1.072 0 CA-C-O 121.77 0.795 . . . . 0.0 110.685 179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.778 HG22 HD13 ' A' ' 27' ' ' LEU . 16.9 t -69.37 -19.35 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.839 0 O-C-N 120.871 -1.143 . . . . 0.0 108.374 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -12.96 61.97 Favored 'General case' 0 N--CA 1.444 -0.747 0 O-C-N 121.061 -1.024 . . . . 0.0 109.705 177.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -98.86 1.03 45.39 Favored 'General case' 0 N--CA 1.438 -1.033 0 C-N-CA 122.657 0.383 . . . . 0.0 110.658 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.748 HG21 ' HA ' ' A' ' 78' ' ' GLN . 3.0 p -71.69 162.5 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.255 0.55 . . . . 0.0 109.826 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.32 -71.01 0.33 Allowed 'General case' 0 CA--C 1.506 -0.74 0 CA-C-O 118.435 -0.793 . . . . 0.0 109.982 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 157.94 -37.36 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.596 0 O-C-N 125.694 1.871 . . . . 0.0 109.688 -179.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.77 -1.18 21.16 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.339 -1.476 . . . . 0.0 110.25 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 63.0 m -113.0 -0.86 14.64 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.748 ' HA ' HG21 ' A' ' 73' ' ' VAL . 7.9 pt20 -59.43 -44.57 92.89 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 121.552 0.691 . . . . 0.0 109.267 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.487 ' CA ' ' HB2' ' A' ' 118' ' ' CYS . 0.0 OUTLIER -73.81 -60.98 2.0 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.624 -1.297 . . . . 0.0 107.615 -178.49 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.407 ' N ' ' SG ' ' A' ' 79' ' ' CYS . 1.2 tp10 -45.75 -24.3 0.35 Allowed 'General case' 0 N--CA 1.446 -0.672 0 O-C-N 124.318 1.011 . . . . 0.0 110.018 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 78' ' ' GLN . . . -61.06 -51.58 68.59 Favored 'General case' 0 N--CA 1.428 -1.564 0 C-N-CA 123.083 0.553 . . . . 0.0 111.245 174.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 25.8 mm -56.98 -34.91 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 120.92 -1.112 . . . . 0.0 110.09 177.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -9.52 47.73 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.891 0.376 . . . . 0.0 110.327 178.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.563 ' CD2' HG12 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -105.67 -65.88 1.03 Allowed 'General case' 0 N--CA 1.432 -1.36 0 C-N-CA 124.66 1.184 . . . . 0.0 110.874 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.519 ' N ' ' CD2' ' A' ' 84' ' ' TYR . 4.4 tp -60.8 -54.57 33.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.825 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -75.78 54.17 0.78 Allowed 'General case' 0 N--CA 1.434 -1.241 0 C-N-CA 123.983 0.913 . . . . 0.0 108.872 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.525 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tt0 -172.95 -53.98 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.12 0.568 . . . . 0.0 110.71 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -59.23 -51.34 70.4 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.152 -0.968 . . . . 0.0 108.658 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.464 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -67.14 -24.57 65.92 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.624 ' HA ' HD23 ' A' ' 95' ' ' LEU . 61.1 mt -68.15 -47.32 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 C-N-CA 123.474 0.709 . . . . 0.0 109.49 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -74.78 -36.54 62.52 Favored 'General case' 0 N--CA 1.443 -0.806 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -53.67 10.02 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-O 121.419 0.628 . . . . 0.0 110.357 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.26 -173.37 2.33 Favored Glycine 0 N--CA 1.437 -1.265 0 CA-C-O 122.892 1.273 . . . . 0.0 110.892 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -86.42 23.68 1.55 Allowed 'General case' 0 C--O 1.204 -1.318 0 O-C-N 121.445 -1.033 . . . . 0.0 110.387 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.801 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.1 OUTLIER -91.3 -1.76 57.57 Favored 'General case' 0 C--O 1.204 -1.314 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.796 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.469 ' CD2' ' H ' ' A' ' 96' ' ' HIS . 0.4 OUTLIER -84.58 176.95 8.27 Favored 'General case' 0 N--CA 1.438 -1.051 0 O-C-N 119.281 -2.137 . . . . 0.0 110.332 178.455 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 85.72 -67.93 3.49 Favored Glycine 0 C--O 1.224 -0.513 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -171.51 35.26 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 123.52 1.629 . . . . 0.0 110.296 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -140.47 29.12 1.98 Allowed 'General case' 0 N--CA 1.446 -0.643 0 O-C-N 120.179 -1.576 . . . . 0.0 109.697 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' CG2' ' A' ' 90' ' ' ILE . 1.3 p -93.58 -29.91 15.24 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -76.84 -27.71 55.23 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.641 0.734 . . . . 0.0 109.627 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.404 ' HG3' ' N ' ' A' ' 103' ' ' VAL . 4.0 ptt180 -69.59 -25.3 63.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.852 178.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.801 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.7 t -81.47 -25.67 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.942 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -48.88 -61.03 2.27 Favored 'General case' 0 N--CA 1.44 -0.931 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.73 -42.73 46.79 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.714 -0.66 . . . . 0.0 110.803 178.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.694 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -51.62 -56.54 13.02 Favored 'General case' 0 C--O 1.213 -0.818 0 O-C-N 124.242 0.963 . . . . 0.0 110.166 178.306 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.609 ' HB1' ' CD ' ' A' ' 31' ' ' GLU . . . -55.22 -48.47 73.85 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 120.856 -1.152 . . . . 0.0 109.847 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.1 -33.05 6.89 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 177.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -53.44 -51.95 61.0 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.892 -0.77 . . . . 0.0 110.527 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.77 ' CD1' HD11 ' A' ' 63' ' ' LEU . 2.4 mm -73.68 -30.81 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.859 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.635 HG21 ' HB3' ' A' ' 119' ' ' MET . 94.8 t -56.39 -47.68 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 24.5 p -60.6 -27.12 67.49 Favored 'General case' 0 N--CA 1.442 -0.875 0 O-C-N 123.306 0.379 . . . . 0.0 110.432 178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.737 ' CB ' HD23 ' A' ' 63' ' ' LEU . 48.2 t -75.25 -77.84 0.12 Allowed 'General case' 0 N--CA 1.434 -1.246 0 CA-C-O 121.181 0.515 . . . . 0.0 109.708 179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.0 t -150.12 41.46 0.82 Allowed 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.513 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -130.09 24.05 4.56 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.426 -1.07 . . . . 0.0 110.426 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.63 ' HA ' HG13 ' A' ' 111' ' ' VAL . 1.7 t -71.4 99.83 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 C-N-CA 123.227 0.611 . . . . 0.0 110.653 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.907 ' HD3' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -144.49 -107.82 0.11 Allowed 'General case' 0 CA--C 1.494 -1.182 0 CA-C-O 118.846 -0.597 . . . . 0.0 111.48 -179.43 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.487 ' HB2' ' CA ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -87.75 -2.04 58.36 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 123.829 0.852 . . . . 0.0 108.84 177.847 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.635 ' HB3' HG21 ' A' ' 111' ' ' VAL . 5.0 tpt -96.94 -0.94 46.72 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-O 120.937 0.399 . . . . 0.0 111.314 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.417 ' HD2' HG22 ' A' ' 116' ' ' VAL . 1.8 ttm180 -144.2 -46.84 0.26 Allowed 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 122.835 0.454 . . . . 0.0 110.565 179.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -132.6 -150.86 0.43 Allowed 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 110.615 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 46.1 p -91.66 -153.19 0.32 Allowed 'General case' 0 N--CA 1.436 -1.14 0 O-C-N 121.659 -0.651 . . . . 0.0 110.308 179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -69.95 -92.91 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.425 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.471 ' O ' HG23 ' A' ' 124' ' ' THR . 2.5 t -58.46 92.61 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 123.779 0.832 . . . . 0.0 110.931 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 C--O 1.248 0.988 0 O-C-N 124.47 1.106 . . . . 0.0 110.556 -177.996 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.135 0 CA-C-O 115.871 -2.014 . . . . 0.0 106.118 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -158.61 -172.68 3.94 Favored 'General case' 0 C--O 1.235 0.327 0 O-C-N 124.867 1.355 . . . . 0.0 109.758 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -159.93 57.46 0.37 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.266 0.555 . . . . 0.0 112.054 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptm -178.26 135.73 0.16 Allowed 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 120.85 -1.156 . . . . 0.0 109.046 -175.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 176.8 174.36 0.4 Allowed 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 124.201 1.0 . . . . 0.0 108.73 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.0 p 173.01 91.42 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 125.116 1.367 . . . . 0.0 110.437 -177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -139.92 179.9 6.33 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.796 -1.19 . . . . 0.0 110.655 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -140.74 -111.68 0.92 Allowed Glycine 0 CA--C 1.51 -0.251 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 178.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -161.5 151.72 17.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 123.655 0.782 . . . . 0.0 110.025 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -65.34 160.61 21.39 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.282 0.364 . . . . 0.0 111.351 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.3 157.68 30.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.183 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 53.54 81.24 0.06 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 123.846 0.736 . . . . 0.0 112.543 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.5 t -155.43 46.64 0.5 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 122.406 1.098 . . . . 0.0 109.412 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.43 157.89 4.72 Favored 'General case' 0 CA--C 1.523 -0.089 0 O-C-N 121.151 -0.968 . . . . 0.0 110.371 176.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.27 -162.65 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.848 0.859 . . . . 0.0 111.103 174.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -36.49 -60.42 0.59 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -164.04 50.22 0.13 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 124.251 1.977 . . . . 0.0 107.268 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.5 t -78.93 -40.57 31.69 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 114.521 -2.657 . . . . 0.0 108.579 175.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -46.13 -60.42 2.3 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 121.094 1.77 . . . . 0.0 114.429 178.642 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.402 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -54.15 -32.65 55.89 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.507 1.123 . . . . 0.0 112.762 174.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' N ' HE21 ' A' ' 20' ' ' GLN . 4.4 mm-40 -79.1 -38.61 35.8 Favored 'General case' 0 C--O 1.2 -1.549 0 O-C-N 120.928 -1.107 . . . . 0.0 112.275 172.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' HB3' ' A' ' 77' ' ' CYS . 17.3 t -70.91 -17.44 20.23 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 O-C-N 118.737 -2.477 . . . . 0.0 110.813 176.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -70.11 -0.04 7.0 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 122.787 1.279 . . . . 0.0 112.535 177.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.75 -33.35 0.14 Allowed 'General case' 0 N--CA 1.44 -0.965 0 CA-C-O 116.398 -1.763 . . . . 0.0 113.88 -171.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 mttt -80.81 -82.19 0.12 Allowed 'General case' 0 CA--C 1.487 -1.452 0 O-C-N 126.891 2.619 . . . . 0.0 110.764 -178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' HG13 ' A' ' 70' ' ' VAL . 10.0 t0 -59.88 -156.32 0.0 OUTLIER 'General case' 0 C--O 1.213 -0.844 0 O-C-N 126.672 2.483 . . . . 0.0 111.703 173.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.603 HD13 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -34.12 91.37 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.157 -1.589 . . . . 0.0 113.981 178.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.6 t -142.04 20.05 2.12 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-O 126.773 3.177 . . . . 0.0 109.186 -169.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -170.93 -32.63 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.02 0 O-C-N 119.495 -2.003 . . . . 0.0 109.772 -178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.469 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.4 m -56.85 -53.62 55.84 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 119.116 0.871 . . . . 0.0 111.538 177.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -71.71 -34.41 69.57 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 123.92 1.819 . . . . 0.0 111.572 173.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -61.2 -27.48 68.46 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 118.379 -2.701 . . . . 0.0 112.937 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -59.76 -54.45 46.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 C-N-CA 127.871 2.468 . . . . 0.0 108.941 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.664 HD13 ' CB ' ' A' ' 106' ' ' ARG . 1.7 pp -77.15 -21.56 53.89 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -76.89 -4.32 43.19 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.944 0.898 . . . . 0.0 112.824 172.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -152.31 -160.56 1.16 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 111.424 -176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.6 t -89.38 -156.01 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 122.434 1.111 . . . . 0.0 110.626 175.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.422 ' HA ' HE21 ' A' ' 62' ' ' GLN . 12.6 p -99.55 -179.49 4.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.355 1.074 . . . . 0.0 111.326 173.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.56 -166.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.119 1.368 . . . . 0.0 109.958 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt-85 -169.84 -45.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.928 0.891 . . . . 0.0 110.861 175.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -56.48 140.47 45.94 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 123.626 0.77 . . . . 0.0 109.414 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 3.3 t -169.41 133.4 1.35 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.9 t -64.12 139.71 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.398 0.618 . . . . 0.0 111.526 174.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -165.06 -117.61 0.41 Allowed Glycine 0 C--O 1.225 -0.453 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 177.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -148.82 -55.45 0.19 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.678 0.791 . . . . 0.0 110.455 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -143.55 102.33 3.92 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-O 122.465 1.126 . . . . 0.0 108.479 -177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.0 p -140.17 20.03 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 CA-C-O 122.779 1.276 . . . . 0.0 110.752 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 pp -106.64 -13.79 15.2 Favored 'General case' 0 C--N 1.329 -0.324 0 O-C-N 121.322 -0.861 . . . . 0.0 112.405 178.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.53 12.66 1.73 Allowed 'General case' 0 C--O 1.225 -0.23 0 C-N-CA 124.498 1.119 . . . . 0.0 113.355 175.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -165.71 88.15 0.93 Allowed Pre-proline 0 C--O 1.22 -0.468 0 O-C-N 123.877 0.735 . . . . 0.0 110.333 -176.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -71.39 -14.82 31.19 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 120.995 1.13 . . . . 0.0 112.932 176.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.77 -91.01 0.2 Allowed Glycine 0 C--O 1.224 -0.48 0 C-N-CA 125.601 1.572 . . . . 0.0 109.881 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -163.65 -55.5 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.233 1.013 . . . . 0.0 110.319 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -104.2 113.33 26.81 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.476 1.111 . . . . 0.0 109.546 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -166.31 131.62 2.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.395 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -72.21 161.06 31.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.496 -0.753 . . . . 0.0 112.089 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -163.29 83.17 0.48 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.558 0.694 . . . . 0.0 110.115 177.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.11 -73.07 0.15 Allowed 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.928 -0.483 . . . . 0.0 110.229 179.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -124.97 21.48 8.17 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.56 1.544 . . . . 0.0 111.183 -177.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.751 ' HB2' HD22 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -172.88 57.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 124.08 1.895 . . . . 0.0 109.02 -173.15 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -68.04 -22.44 64.95 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 119.64 -1.913 . . . . 0.0 111.332 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.422 HE21 ' HA ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -67.85 -25.98 65.81 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 123.01 1.386 . . . . 0.0 111.618 176.767 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.072 HD11 HD12 ' A' ' 110' ' ' ILE . 2.3 mp -69.63 -19.02 63.63 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 120.279 -1.513 . . . . 0.0 111.604 178.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -49.16 -36.74 20.17 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 118.703 0.683 . . . . 0.0 111.45 170.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -67.2 -43.84 81.12 Favored 'General case' 0 CA--C 1.491 -1.297 0 CA-C-O 115.673 -2.108 . . . . 0.0 108.941 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.76 ' O ' HG23 ' A' ' 70' ' ' VAL . 37.4 t -56.48 -55.45 33.57 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-O 116.663 -1.637 . . . . 0.0 110.817 171.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 8.3 t -54.82 -53.2 58.34 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 121.283 1.856 . . . . 0.0 112.863 178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -53.06 -37.93 62.03 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.249 0.62 . . . . 0.0 111.808 173.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.6 mm-40 -66.05 -51.84 54.47 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-O 123.811 1.767 . . . . 0.0 108.801 179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.76 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.7 t -68.7 -21.37 25.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 O-C-N 118.373 -2.704 . . . . 0.0 111.731 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -73.33 -12.43 60.83 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 120.166 -1.584 . . . . 0.0 111.096 173.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -87.72 0.0 56.31 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.789 -1.195 . . . . 0.0 112.0 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.525 HG22 ' H ' ' A' ' 74' ' ' ARG . 2.1 p -65.52 171.44 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 CA-C-O 122.561 1.172 . . . . 0.0 111.511 177.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.525 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -88.77 -61.76 1.64 Allowed 'General case' 0 CA--C 1.498 -1.041 0 CA-C-O 116.735 -1.602 . . . . 0.0 109.906 179.03 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 172.13 -64.02 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 O-C-N 127.445 2.965 . . . . 0.0 109.672 -177.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -99.33 39.39 1.3 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 124.132 1.92 . . . . 0.0 110.585 -177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.476 ' HB3' HG21 ' A' ' 22' ' ' VAL . 1.3 m -128.7 10.09 6.01 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.731 175.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -65.07 -78.51 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 122.884 1.326 . . . . 0.0 113.424 -178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 1.8 m -57.62 -44.53 85.59 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 119.895 -1.753 . . . . 0.0 110.671 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -45.87 -44.57 14.53 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 123.925 0.766 . . . . 0.0 112.442 172.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.669 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -59.88 -48.95 79.61 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 113.685 0.994 . . . . 0.0 113.685 172.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 82' ' ' ILE . 1.5 mm -58.75 -48.76 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 124.059 0.944 . . . . 0.0 111.592 175.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.74 -3.05 13.7 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.16 -0.962 . . . . 0.0 113.332 174.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.497 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 34.2 t80 -108.17 11.13 27.72 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 128.538 2.735 . . . . 0.0 112.129 175.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.669 HG22 ' O ' ' A' ' 81' ' ' ALA . 0.6 OUTLIER -155.63 -62.23 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.205 -1.286 0 CA-C-O 116.339 -1.791 . . . . 0.0 109.879 -177.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.568 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -59.46 -61.4 2.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 120.262 1.392 . . . . 0.0 109.87 174.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.455 ' HA ' HD12 ' A' ' 90' ' ' ILE . 0.7 OUTLIER -70.67 -32.93 70.38 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 121.125 -0.985 . . . . 0.0 112.576 179.487 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -64.38 -58.23 7.06 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.746 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.586 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.2 pt20 -56.4 -35.15 67.45 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 115.839 -2.029 . . . . 0.0 109.131 175.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.653 HG13 HG11 ' A' ' 103' ' ' VAL . 10.2 mt -57.7 -46.17 86.72 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 120.395 1.452 . . . . 0.0 110.421 177.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -73.22 -45.9 53.4 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 121.128 -0.983 . . . . 0.0 112.914 176.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.69 -58.34 7.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 122.057 0.932 . . . . 0.0 112.968 -178.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.416 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.45 174.77 6.17 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 124.352 2.085 . . . . 0.0 112.335 172.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.75 37.74 0.36 Allowed 'General case' 0 C--O 1.206 -1.21 0 O-C-N 120.27 -1.724 . . . . 0.0 111.494 178.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.758 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.6 OUTLIER -89.38 15.29 9.39 Favored 'General case' 0 C--O 1.214 -0.805 0 O-C-N 119.122 -2.236 . . . . 0.0 108.205 -178.301 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -92.28 -178.29 4.9 Favored 'General case' 0 C--O 1.214 -0.787 0 O-C-N 119.15 -2.219 . . . . 0.0 111.379 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.24 -64.88 3.91 Favored Glycine 0 C--O 1.221 -0.702 0 CA-C-O 117.658 -1.634 . . . . 0.0 109.623 -178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -174.09 49.61 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 124.751 2.215 . . . . 0.0 112.96 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -154.65 21.67 0.46 Allowed 'General case' 0 C--N 1.323 -0.544 0 O-C-N 119.303 -2.123 . . . . 0.0 110.305 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' HG23 ' A' ' 90' ' ' ILE . 0.0 OUTLIER -92.08 -39.79 11.42 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 123.778 0.831 . . . . 0.0 109.221 179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.64 -31.92 70.3 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.221 1.486 . . . . 0.0 109.25 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.58 -23.28 67.21 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 119.891 -1.756 . . . . 0.0 111.701 176.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.758 HG21 ' HG ' ' A' ' 95' ' ' LEU . 6.7 t -82.56 -28.21 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 119.392 0.996 . . . . 0.0 109.805 177.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.62 -41.86 98.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.059 0.457 . . . . 0.0 110.739 177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -67.04 -37.29 83.84 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.962 -0.461 . . . . 0.0 111.163 177.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.664 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -62.71 -58.4 7.61 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 124.334 1.054 . . . . 0.0 109.271 -176.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.664 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.8 -37.46 82.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 118.544 -0.741 . . . . 0.0 109.504 -179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.413 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.54 -33.11 17.09 Favored Glycine 0 CA--C 1.527 0.786 0 C-N-CA 126.462 1.982 . . . . 0.0 113.889 172.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -58.92 -57.78 11.56 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 123.55 1.643 . . . . 0.0 110.45 175.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 1.072 HD12 HD11 ' A' ' 63' ' ' LEU . 2.2 mm -72.93 -25.91 22.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 120.93 -1.106 . . . . 0.0 110.545 -178.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.777 HG21 ' CB ' ' A' ' 119' ' ' MET . 24.3 t -60.23 -50.54 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.807 0 CA-C-O 117.661 -1.161 . . . . 0.0 110.078 173.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.6 p -55.17 -23.58 22.39 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 124.131 0.894 . . . . 0.0 112.799 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.722 ' HB2' HD23 ' A' ' 63' ' ' LEU . 5.1 t -72.67 -68.55 0.47 Allowed 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.975 0.91 . . . . 0.0 111.229 174.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 31.6 t -162.1 37.15 0.12 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 123.631 1.681 . . . . 0.0 109.969 -179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.427 ' CA ' ' HA ' ' A' ' 111' ' ' VAL . . . -128.82 29.76 3.89 Favored Glycine 0 C--O 1.22 -0.774 0 CA-C-O 116.622 -2.21 . . . . 0.0 110.217 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.618 ' HA ' HG13 ' A' ' 111' ' ' VAL . 48.1 t -64.7 63.83 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 126.491 1.917 . . . . 0.0 111.62 175.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.441 ' HE ' ' N ' ' A' ' 116' ' ' VAL . 0.0 OUTLIER -99.22 -81.73 0.45 Allowed 'General case' 0 CA--C 1.484 -1.58 0 N-CA-C 106.658 -1.608 . . . . 0.0 106.658 -174.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.19 -2.04 13.49 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.777 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.96 10.59 39.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 122.311 1.053 . . . . 0.0 112.374 179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.563 ' CG ' HG13 ' A' ' 116' ' ' VAL . 1.2 tpt180 -154.55 -47.4 0.09 Allowed 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 116.906 -1.521 . . . . 0.0 110.374 177.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -125.21 -163.59 1.21 Allowed 'General case' 0 CA--C 1.52 -0.194 0 O-C-N 125.818 1.949 . . . . 0.0 110.581 -178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.8 p -95.69 -162.4 0.95 Allowed 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 125.191 1.396 . . . . 0.0 110.008 177.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -37.03 -85.97 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.368 0 N-CA-C 114.907 1.447 . . . . 0.0 114.907 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 1.8 t -56.06 158.94 3.6 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 124.068 0.947 . . . . 0.0 111.604 172.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 19.6 t30 . . . . . 0 C--O 1.25 1.111 0 CA-C-O 116.116 -1.897 . . . . 0.0 113.12 170.788 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.696 0 CA-C-O 117.847 -1.073 . . . . 0.0 108.547 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -165.18 136.08 3.93 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 124.862 1.351 . . . . 0.0 109.668 -179.111 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -161.0 167.76 25.85 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.14 155.7 0.08 Allowed 'General case' 0 C--O 1.233 0.189 0 O-C-N 124.418 1.074 . . . . 0.0 112.607 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -86.61 177.77 7.27 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.839 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 166.64 103.11 0.0 OUTLIER 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.528 0.731 . . . . 0.0 110.12 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.42 -172.8 4.17 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.521 0.728 . . . . 0.0 110.526 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.33 -112.08 3.4 Favored Glycine 0 C--O 1.224 -0.519 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -159.39 155.95 27.61 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 ttm-85 -161.66 160.96 29.32 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.36 165.22 28.1 Favored 'General case' 0 C--O 1.233 0.203 0 O-C-N 123.527 0.517 . . . . 0.0 111.247 178.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 136.34 100.12 0.58 Allowed Glycine 0 C--O 1.224 -0.503 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 t -177.62 102.35 0.05 OUTLIER 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HB3' ' CZ ' ' A' ' 19' ' ' ARG . 41.7 t -170.14 -153.66 0.1 Allowed 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.44 1.096 . . . . 0.0 108.886 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.58 -153.26 0.15 Allowed 'General case' 0 N--CA 1.435 -1.194 0 C-N-CA 124.417 1.087 . . . . 0.0 111.589 176.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -69.97 -53.9 15.68 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.627 0.727 . . . . 0.0 111.042 178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -158.18 41.54 0.27 Allowed 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 122.549 1.166 . . . . 0.0 109.375 -178.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' O ' ' C ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -78.6 -59.63 2.7 Favored 'General case' 0 C--O 1.189 -2.116 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 179.789 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.442 ' C ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -12.94 -66.23 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.398 0 C-N-CA 124.399 1.079 . . . . 0.0 112.866 176.512 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.418 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -44.03 -75.23 0.03 OUTLIER 'General case' 0 C--O 1.215 -0.739 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 169.613 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' N ' HE21 ' A' ' 20' ' ' GLN . 4.1 pt-20 -53.79 -25.88 21.28 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 115.062 1.505 . . . . 0.0 115.062 173.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 77' ' ' CYS . 5.5 t -66.33 -58.85 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 114.498 -2.668 . . . . 0.0 106.681 179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.418 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -68.71 44.84 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 O-C-N 125.469 1.73 . . . . 0.0 113.731 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -151.08 -46.8 0.12 Allowed 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 125.482 1.513 . . . . 0.0 111.389 -175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -116.13 -28.21 6.66 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 124.653 1.221 . . . . 0.0 111.995 179.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.814 ' HA ' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -53.07 -161.89 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.752 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 173.639 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.647 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.2 mm? -53.83 79.61 0.0 OUTLIER 'General case' 0 N--CA 1.432 -1.33 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 168.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -130.37 45.97 2.73 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.698 1.599 . . . . 0.0 108.826 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -174.6 -36.29 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.412 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' HD12 ' A' ' 27' ' ' LEU . 4.5 m -61.94 -54.72 37.88 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.312 0.577 . . . . 0.0 110.427 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.569 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.0 OUTLIER -72.9 -30.13 63.69 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 120.072 -0.651 . . . . 0.0 110.871 177.273 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.9 ttp180 -65.4 -34.57 78.63 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 118.883 -0.58 . . . . 0.0 111.478 177.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.487 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 48.7 t80 -53.24 -52.81 57.75 Favored 'General case' 0 N--CA 1.443 -0.798 0 C-N-CA 125.406 1.482 . . . . 0.0 110.321 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.601 HD13 ' HG2' ' A' ' 106' ' ' ARG . 3.9 pp -77.22 -22.06 52.88 Favored 'General case' 0 N--CA 1.45 -0.467 0 O-C-N 123.894 0.746 . . . . 0.0 111.57 176.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.6 ttp180 -80.13 -2.91 46.61 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.36 -159.94 1.02 Allowed 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.516 1.126 . . . . 0.0 111.173 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -89.07 -154.17 0.29 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.428 1.109 . . . . 0.0 110.846 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.7 p -78.28 112.48 15.32 Favored 'General case' 0 N--CA 1.443 -0.784 0 O-C-N 121.566 -0.709 . . . . 0.0 111.046 176.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.7 t -41.93 132.28 3.15 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.718 0.407 . . . . 0.0 110.929 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.6 ttt180 -147.52 69.47 1.15 Allowed 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -177.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 9.7 ttt-85 -176.92 129.37 0.17 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.673 -0.68 . . . . 0.0 110.027 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.98 145.93 2.4 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 124.377 1.048 . . . . 0.0 109.395 179.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 45.1 m -77.33 146.6 36.66 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 123.487 0.492 . . . . 0.0 110.677 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 115.61 123.6 3.65 Favored Glycine 0 CA--C 1.523 0.557 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -64.84 -50.44 66.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.913 0.387 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -89.48 59.38 4.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.146 0.974 . . . . 0.0 110.459 179.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.2 p -89.47 23.01 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.731 0.777 . . . . 0.0 111.286 178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.1 mp -124.4 50.3 1.71 Allowed 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.631 0.729 . . . . 0.0 109.643 -179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.67 159.43 24.95 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.836 178.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 mmm -42.74 148.15 0.58 Allowed Pre-proline 0 CA--C 1.54 0.563 0 O-C-N 124.029 0.831 . . . . 0.0 112.935 178.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -70.65 125.23 11.46 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 N-CA-C 108.896 -1.232 . . . . 0.0 108.896 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.7 92.48 1.37 Allowed Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 109.884 -1.287 . . . . 0.0 109.884 174.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 174.96 -52.74 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.228 0 O-C-N 125.01 1.065 . . . . 0.0 109.067 -178.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -108.04 43.18 1.24 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 121.746 0.784 . . . . 0.0 110.543 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -177.11 167.62 2.41 Favored 'General case' 0 N--CA 1.447 -0.576 0 O-C-N 121.082 -1.011 . . . . 0.0 108.93 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 mm-40 -57.46 -80.51 0.02 OUTLIER 'General case' 0 C--O 1.227 -0.117 0 O-C-N 124.059 0.849 . . . . 0.0 112.419 175.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -127.48 159.1 35.58 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.672 0.748 . . . . 0.0 111.314 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.99 95.57 9.56 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.036 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -179.55 31.5 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.846 0.716 . . . . 0.0 111.395 -176.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 7.5 p 170.74 85.62 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.969 0.89 . . . . 0.0 109.642 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -57.58 -21.17 37.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 122.297 1.046 . . . . 0.0 111.8 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.487 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 2.2 mp0 -75.93 -57.39 3.91 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 121.546 -0.722 . . . . 0.0 111.741 -179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.94 HD11 HD12 ' A' ' 110' ' ' ILE . 6.4 mp -54.57 -29.51 51.51 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.956 0.16 . . . . 0.0 110.805 175.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.94 -34.66 63.45 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 173.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -33.59 71.85 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.508 178.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.848 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.4 t -71.15 -51.33 25.54 Favored 'General case' 0 C--O 1.204 -1.331 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 176.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.8 t -56.19 -53.67 54.33 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.888 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -56.68 -27.51 58.97 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 123.884 0.74 . . . . 0.0 112.379 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -75.77 -46.75 29.09 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 123.015 1.388 . . . . 0.0 111.055 175.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.848 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.4 t -73.79 -17.47 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.085 0 O-C-N 119.057 -2.277 . . . . 0.0 110.196 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -77.07 -22.41 52.9 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 123.222 0.609 . . . . 0.0 110.334 177.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -96.36 9.55 40.84 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 123.49 0.494 . . . . 0.0 111.943 175.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.814 HG23 ' HA ' ' A' ' 26' ' ' ASP . 2.3 p -67.77 -175.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 C-N-CA 122.974 0.51 . . . . 0.0 111.526 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.662 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -76.11 -92.08 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 119.088 -0.482 . . . . 0.0 112.062 176.026 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -175.9 -43.27 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.288 1.435 . . . . 0.0 110.909 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -112.3 -4.13 14.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.832 0.825 . . . . 0.0 112.278 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 20.7 m -94.04 8.25 42.14 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.056 176.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.614 ' HG3' HG11 ' A' ' 73' ' ' VAL . 1.2 mp0 -65.65 -49.53 68.3 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.811 0.815 . . . . 0.0 111.34 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.84 -54.71 6.8 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.004 178.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -51.28 -21.54 2.2 Favored 'General case' 0 C--O 1.216 -0.706 0 O-C-N 125.047 1.467 . . . . 0.0 111.203 176.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.669 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -71.92 -44.29 63.89 Favored 'General case' 0 N--CA 1.439 -0.995 0 O-C-N 120.641 -1.287 . . . . 0.0 113.401 174.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.703 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 8.3 mm -60.8 -33.78 56.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 0 O-C-N 122.112 -0.367 . . . . 0.0 110.92 172.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -67.23 -7.97 28.06 Favored 'General case' 0 C--O 1.222 -0.386 0 O-C-N 121.95 -0.468 . . . . 0.0 111.631 178.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -104.35 -64.92 1.06 Allowed 'General case' 0 N--CA 1.437 -1.086 0 C-N-CA 124.72 1.208 . . . . 0.0 110.779 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.436 HG21 ' CB ' ' A' ' 27' ' ' LEU . 8.3 tp -61.34 -44.63 98.82 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.645 -176.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.703 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -75.63 48.26 0.44 Allowed 'General case' 0 N--CA 1.438 -1.039 0 C-N-CA 124.871 1.268 . . . . 0.0 112.187 177.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -176.82 -55.67 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.885 -177.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -54.89 -43.41 73.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.725 0.774 . . . . 0.0 109.295 178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -22.29 61.07 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 176.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 95' ' ' LEU . 9.2 mt -72.12 -48.96 46.86 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 C-N-CA 124.1 0.96 . . . . 0.0 108.889 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -36.86 71.05 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.803 -0.56 . . . . 0.0 112.231 177.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.52 -54.74 6.92 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 123.421 0.689 . . . . 0.0 111.443 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -63.11 -179.5 4.91 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 123.029 1.35 . . . . 0.0 112.318 175.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.76 40.35 0.74 Allowed 'General case' 0 C--O 1.217 -0.654 0 O-C-N 121.424 -1.045 . . . . 0.0 112.212 179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -95.94 95.33 8.16 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 -172.531 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -154.0 168.93 24.78 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.352 -177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 81.08 -70.1 3.14 Favored Glycine 0 C--O 1.223 -0.585 0 CA-C-O 118.469 -1.184 . . . . 0.0 110.236 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -176.04 47.85 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 124.033 1.873 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.476 ' OE2' HD13 ' A' ' 95' ' ' LEU . 5.9 pt-20 -129.82 18.45 5.65 Favored 'General case' 0 C--O 1.209 -1.07 0 O-C-N 120.444 -1.41 . . . . 0.0 109.176 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -83.8 -32.68 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.097 -1.002 . . . . 0.0 110.742 178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.45 -26.16 63.52 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 122.152 0.977 . . . . 0.0 110.452 -179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -68.92 -21.37 64.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.676 -0.64 . . . . 0.0 111.593 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 95' ' ' LEU . 1.4 t -80.83 -28.15 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 C-N-CA 123.885 0.874 . . . . 0.0 109.433 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.71 -50.07 68.4 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.558 0.694 . . . . 0.0 109.722 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.91 -31.54 68.19 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.414 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.601 ' HG2' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -56.29 -58.98 5.69 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 123.705 0.628 . . . . 0.0 110.385 179.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.639 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -60.12 -34.83 74.07 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.699 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -47.69 -31.83 7.69 Favored Glycine 0 CA--C 1.535 1.337 0 O-C-N 124.89 1.369 . . . . 0.0 113.134 173.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -58.75 -56.45 22.1 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 121.367 0.603 . . . . 0.0 110.935 176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.94 HD12 HD11 ' A' ' 63' ' ' LEU . 3.0 mm -73.18 -24.6 20.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.584 0.707 . . . . 0.0 110.638 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.737 HG13 ' HA ' ' A' ' 116' ' ' VAL . 44.6 t -56.9 -46.58 83.74 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.385 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.412 174.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 10.0 p -62.43 -24.63 67.52 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.016 0.823 . . . . 0.0 112.122 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.547 ' HB2' HD23 ' A' ' 63' ' ' LEU . 45.9 t -76.78 -78.1 0.13 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.542 0.687 . . . . 0.0 111.119 178.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.491 ' O ' HG21 ' A' ' 70' ' ' VAL . 5.3 t -144.81 40.58 1.28 Allowed 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 121.467 -0.77 . . . . 0.0 109.441 178.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.479 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -135.46 22.86 3.49 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 111.02 -0.832 . . . . 0.0 111.02 -178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.905 HG23 ' HB3' ' A' ' 120' ' ' ARG . 7.2 p -71.78 59.17 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.94 0 C-N-CA 124.818 1.247 . . . . 0.0 111.27 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.589 ' HD3' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -94.52 -94.43 0.17 Allowed 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.655 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.16 -0.78 32.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 120.643 0.259 . . . . 0.0 110.77 174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.702 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -90.17 1.19 56.69 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.539 0.685 . . . . 0.0 112.661 178.354 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.905 ' HB3' HG23 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -160.02 -45.98 0.05 OUTLIER 'General case' 0 N--CA 1.44 -0.947 0 C-N-CA 123.303 0.641 . . . . 0.0 110.041 177.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.684 ' HB2' HG22 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -90.06 -141.5 0.15 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-O 121.39 0.614 . . . . 0.0 109.682 -178.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.48 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.2 m -141.58 -147.55 0.22 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 -177.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.48 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -36.06 -66.54 0.2 Allowed 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 124.332 1.053 . . . . 0.0 110.874 179.685 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.78 140.74 52.69 Favored 'General case' 0 N--CA 1.442 -0.866 0 O-C-N 124.358 1.036 . . . . 0.0 109.24 179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.4 ' ND2' ' H ' ' A' ' 125' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 116.21 -1.852 . . . . 0.0 112.655 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.84 138.8 32.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.081 0.467 . . . . 0.0 110.515 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -52.23 131.61 32.79 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 122.15 0.976 . . . . 0.0 111.041 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 22.0 ptp -145.62 164.16 32.58 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 121.667 -0.646 . . . . 0.0 110.658 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.84 174.38 0.62 Allowed 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.718 1.247 . . . . 0.0 110.433 178.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 174.58 155.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.029 -1.044 . . . . 0.0 109.282 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mttt -67.25 120.44 13.8 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -155.96 82.44 0.16 Allowed Glycine 0 C--O 1.222 -0.623 0 N-CA-C 110.406 -1.078 . . . . 0.0 110.406 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -90.24 -36.86 14.49 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 124.046 0.498 . . . . 0.0 110.779 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 162.68 0.83 Allowed 'General case' 0 C--N 1.345 0.376 0 CA-C-O 121.367 0.604 . . . . 0.0 110.142 178.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -105.87 170.55 7.84 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.762 177.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.81 171.15 27.12 Favored Glycine 0 CA--C 1.502 -0.731 0 CA-C-O 116.713 -2.159 . . . . 0.0 111.764 177.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 160.3 122.45 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.8 0 O-C-N 126.764 2.096 . . . . 0.0 109.83 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.4 p -65.51 135.26 54.92 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 117.158 -1.401 . . . . 0.0 108.336 179.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.449 ' O ' ' C ' ' A' ' 16' ' ' GLN . 6.0 t -55.1 180.0 0.02 OUTLIER 'General case' 0 C--O 1.24 0.584 0 O-C-N 126.323 2.265 . . . . 0.0 108.854 -179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.449 ' C ' ' O ' ' A' ' 15' ' ' SER . 20.1 tt0 -42.02 -54.18 3.62 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.075 -1.016 . . . . 0.0 110.136 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 19' ' ' ARG . 31.8 mt-30 -155.02 56.94 0.66 Allowed 'General case' 0 N--CA 1.439 -0.985 0 O-C-N 123.722 0.639 . . . . 0.0 110.244 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.69 -53.02 6.56 Favored 'General case' 0 C--O 1.195 -1.798 0 CA-C-O 115.706 -2.092 . . . . 0.0 108.108 -179.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -34.89 -39.49 0.1 Allowed 'General case' 0 C--O 1.194 -1.832 0 CA-C-N 121.67 2.032 . . . . 0.0 111.914 174.721 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.486 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -53.88 -70.29 0.1 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.007 0.923 . . . . 0.0 108.943 177.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.486 ' N ' HE21 ' A' ' 20' ' ' GLN . 18.0 pt-20 -69.08 -33.88 74.23 Favored 'General case' 0 C--O 1.197 -1.668 0 CA-C-O 117.034 -1.46 . . . . 0.0 112.339 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.686 HG21 ' HB3' ' A' ' 77' ' ' CYS . 2.2 t -59.22 -24.43 27.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 127.368 2.267 . . . . 0.0 109.249 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.506 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 1.7 mt-30 -68.7 -4.88 17.39 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-O 122.571 1.177 . . . . 0.0 112.737 175.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.47 19.06 0.28 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 124.788 1.235 . . . . 0.0 110.466 -174.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HZ1' ' NE ' ' A' ' 74' ' ' ARG . 0.7 OUTLIER -138.45 -89.8 0.22 Allowed 'General case' 0 CA--C 1.498 -1.037 0 CA-C-O 116.204 -1.855 . . . . 0.0 107.766 -176.804 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.671 ' HA ' HG22 ' A' ' 73' ' ' VAL . 1.2 m-20 -48.13 162.57 0.08 Allowed 'General case' 0 CA--C 1.484 -1.589 0 O-C-N 127.583 3.052 . . . . 0.0 107.744 -176.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.876 HD22 ' H ' ' A' ' 27' ' ' LEU . 2.4 mm? -3.1 80.36 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 126.528 2.393 . . . . 0.0 113.81 179.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.4 t -137.58 35.86 2.45 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 124.947 2.308 . . . . 0.0 105.865 -167.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.61 -33.74 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.44 0 O-C-N 119.005 -2.309 . . . . 0.0 108.834 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 14.1 m -54.83 -51.05 67.08 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 119.606 1.094 . . . . 0.0 109.876 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.598 ' CD ' ' HB1' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -78.56 -31.37 47.34 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -179.238 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -61.88 -36.67 81.96 Favored 'General case' 0 C--O 1.209 -1.03 0 CA-C-O 117.65 -1.167 . . . . 0.0 110.838 177.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.501 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 54.2 t80 -55.33 -44.47 75.89 Favored 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 126.531 1.932 . . . . 0.0 109.723 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -74.75 -28.84 60.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.851 0.719 . . . . 0.0 109.892 178.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.41 -46.27 77.13 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.221 -0.895 . . . . 0.0 109.475 178.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -79.03 -165.31 0.73 Allowed 'General case' 0 N--CA 1.438 -1.062 0 O-C-N 124.039 0.837 . . . . 0.0 110.256 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.0 t -143.86 -159.49 0.99 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.789 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.2 p -45.53 116.78 1.24 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.808 0.813 . . . . 0.0 110.748 177.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.7 p -176.2 104.16 0.07 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 122.753 1.263 . . . . 0.0 109.795 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 -61.05 -172.43 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 O-C-N 120.752 -1.217 . . . . 0.0 110.912 178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.95 175.49 0.06 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.79 174.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 1.5 t -89.24 -150.67 0.21 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.441 1.115 . . . . 0.0 109.737 177.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.8 p -79.15 98.82 6.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 123.76 1.743 . . . . 0.0 110.512 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.38 -119.23 0.7 Allowed Glycine 0 C--O 1.222 -0.596 0 O-C-N 119.612 -1.93 . . . . 0.0 110.998 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -150.26 -65.97 0.2 Allowed 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.987 0.463 . . . . 0.0 110.606 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.98 -156.87 0.74 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 47' ' ' VAL . 75.9 t -145.44 31.33 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 CA-C-O 122.281 1.038 . . . . 0.0 109.805 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 38.4 mt -117.85 26.45 9.67 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.258 -0.901 . . . . 0.0 109.548 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.5 149.97 31.32 Favored 'General case' 0 C--O 1.216 -0.69 0 O-C-N 121.019 -1.051 . . . . 0.0 109.104 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.41 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 3.2 mtm -42.17 -51.28 10.75 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.576 173.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.41 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 28.9 Cg_endo -73.75 57.06 3.64 Favored 'Trans proline' 0 N--CA 1.452 -0.955 0 C-N-CA 123.049 2.499 . . . . 0.0 112.197 176.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 121.31 89.08 1.03 Allowed Glycine 0 N--CA 1.442 -0.912 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -177.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -166.77 -74.08 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.644 0.85 . . . . 0.0 109.892 178.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -63.99 85.85 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 124.548 1.155 . . . . 0.0 108.254 -177.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' A' ' 64' ' ' GLN . 8.7 t30 -137.94 120.57 16.21 Favored 'General case' 0 CA--C 1.498 -1.022 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 -176.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.16 97.46 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 125.602 1.814 . . . . 0.0 112.14 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -169.65 130.45 1.05 Allowed 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -175.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.29 -75.82 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.302 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -135.03 72.0 1.45 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.584 1.183 . . . . 0.0 108.932 -176.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.6 t -166.66 74.88 0.17 Allowed 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 122.974 1.369 . . . . 0.0 108.254 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -67.7 -8.28 33.9 Favored 'General case' 0 C--O 1.219 -0.517 0 O-C-N 120.153 -1.592 . . . . 0.0 110.497 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.501 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 14.3 mm-40 -70.35 -52.19 24.43 Favored 'General case' 0 N--CA 1.439 -1.006 0 O-C-N 121.329 -0.857 . . . . 0.0 110.938 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.896 HD11 HD12 ' A' ' 110' ' ' ILE . 5.8 mp -66.86 -26.79 67.07 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.429 ' HA ' ' ND2' ' A' ' 55' ' ' ASN . 34.2 tt0 -51.25 -27.99 10.57 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 118.923 0.783 . . . . 0.0 111.233 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -33.55 66.4 Favored 'General case' 0 C--O 1.198 -1.644 0 CA-C-O 116.012 -1.947 . . . . 0.0 109.78 177.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.622 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.5 t -73.25 -47.69 41.08 Favored 'General case' 0 C--O 1.202 -1.44 0 CA-C-N 121.485 1.948 . . . . 0.0 109.314 176.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 2.9 t -61.04 -49.24 78.18 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 120.795 1.634 . . . . 0.0 110.409 178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -62.39 -25.44 67.93 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.299 0.571 . . . . 0.0 110.499 176.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -78.18 -45.73 22.36 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.989 -0.445 . . . . 0.0 111.129 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.851 HG11 ' CZ ' ' A' ' 117' ' ' ARG . 18.2 t -73.78 -8.11 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.921 0 C-N-CA 124.69 1.196 . . . . 0.0 108.848 178.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.63 -22.24 57.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 O-C-N 120.195 -1.566 . . . . 0.0 109.745 177.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -97.5 8.71 44.11 Favored 'General case' 0 C--O 1.205 -1.239 0 CA-C-O 117.089 -1.434 . . . . 0.0 109.622 176.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' A' ' 70' ' ' VAL . 4.9 t -68.81 160.9 4.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 121.037 1.744 . . . . 0.0 110.598 178.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.534 ' NE ' ' HZ1' ' A' ' 25' ' ' LYS . 8.9 mmt180 -81.77 -66.54 0.88 Allowed 'General case' 0 CA--C 1.493 -1.228 0 CA-C-O 116.351 -1.785 . . . . 0.0 112.57 174.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 156.36 -46.66 0.0 OUTLIER 'General case' 0 C--O 1.217 -0.642 0 O-C-N 126.469 2.356 . . . . 0.0 110.346 -175.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.51 -2.46 21.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 105.098 -2.186 . . . . 0.0 105.098 -173.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.686 ' HB3' HG21 ' A' ' 22' ' ' VAL . 2.4 m -101.77 -4.11 26.95 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.677 -1.264 . . . . 0.0 108.2 177.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HB2' ' CD ' ' A' ' 117' ' ' ARG . 4.1 pt20 -63.59 -48.8 75.91 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 122.775 1.274 . . . . 0.0 107.914 -178.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -56.63 4.7 Favored 'General case' 0 N--CA 1.436 -1.165 0 O-C-N 118.694 -2.504 . . . . 0.0 107.737 -176.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -47.16 -28.1 1.7 Allowed 'General case' 0 C--O 1.217 -0.647 0 O-C-N 124.897 1.373 . . . . 0.0 111.451 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.568 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -69.44 -51.37 36.91 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 173.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.516 ' CD1' ' HG ' ' A' ' 27' ' ' LEU . 24.4 mm -56.74 -45.28 82.85 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.985 0 O-C-N 120.827 -1.171 . . . . 0.0 109.987 175.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.73 -5.31 24.32 Favored 'General case' 0 C--O 1.215 -0.744 0 O-C-N 119.214 -2.179 . . . . 0.0 111.423 177.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.506 ' CE2' ' HA ' ' A' ' 23' ' ' GLN . 7.0 t80 -104.24 10.03 35.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 124.312 2.006 . . . . 0.0 110.922 177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 81' ' ' ALA . 11.7 tt -154.4 -58.65 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.211 -0.969 0 O-C-N 118.227 -2.796 . . . . 0.0 108.911 -178.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.537 ' H ' HG23 ' A' ' 85' ' ' ILE . . . -57.37 -57.97 10.31 Favored 'General case' 0 C--O 1.204 -1.308 0 C-N-CA 125.073 1.349 . . . . 0.0 109.569 176.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -73.88 -37.12 64.82 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 119.243 0.929 . . . . 0.0 110.911 179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -57.8 -58.55 7.87 Favored 'General case' 0 C--O 1.199 -1.571 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.607 ' O ' HD23 ' A' ' 95' ' ' LEU . 6.4 pt20 -59.12 -34.36 71.94 Favored 'General case' 0 C--O 1.194 -1.857 0 O-C-N 117.531 -3.231 . . . . 0.0 107.937 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.662 HG13 HG11 ' A' ' 103' ' ' VAL . 29.6 mt -61.98 -44.19 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 122.398 2.363 . . . . 0.0 109.722 179.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.403 ' O ' ' CE1' ' A' ' 96' ' ' HIS . 14.2 pt20 -80.15 -29.11 38.77 Favored 'General case' 0 N--CA 1.441 -0.89 0 O-C-N 120.885 -1.134 . . . . 0.0 109.625 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -58.58 3.07 Favored 'General case' 0 N--CA 1.437 -1.123 0 O-C-N 117.81 -3.056 . . . . 0.0 107.569 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.49 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.26 -177.3 2.18 Favored Glycine 0 C--O 1.214 -1.129 0 C-N-CA 125.39 1.471 . . . . 0.0 111.746 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -86.38 42.04 0.97 Allowed 'General case' 0 C--O 1.193 -1.882 0 O-C-N 120.982 -1.305 . . . . 0.0 109.854 178.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.711 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.04 26.32 2.17 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 117.933 -2.979 . . . . 0.0 109.68 179.718 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.448 ' CD2' ' N ' ' A' ' 96' ' ' HIS . 4.0 m-70 -93.34 157.9 16.01 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.316 1.055 . . . . 0.0 109.614 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 92.88 -74.15 1.31 Allowed Glycine 0 C--O 1.22 -0.736 0 O-C-N 120.492 -1.38 . . . . 0.0 111.203 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -167.07 31.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 124.669 2.176 . . . . 0.0 110.443 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.69 -2.31 17.51 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 119.2 -2.187 . . . . 0.0 108.331 -176.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -31.68 72.87 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.711 -0.618 . . . . 0.0 110.15 178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -68.69 -25.1 64.62 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.445 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 8.1 mtp85 -71.83 -24.97 61.8 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 121.808 -0.557 . . . . 0.0 110.181 177.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.711 HG21 ' HG ' ' A' ' 95' ' ' LEU . 2.6 t -82.35 -33.04 10.96 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 O-C-N 121.203 -0.936 . . . . 0.0 110.059 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.86 -37.88 89.03 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' NE2' ' HA ' ' A' ' 102' ' ' ARG . 17.1 pt20 -68.82 -36.43 78.2 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-O 117.607 -1.187 . . . . 0.0 109.577 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.711 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -70.89 -62.9 1.22 Allowed 'General case' 0 C--O 1.207 -1.16 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 -177.637 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.734 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -59.78 -45.26 92.84 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-O 117.964 -1.017 . . . . 0.0 108.763 -176.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -43.18 -37.89 3.39 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.354 0.978 . . . . 0.0 112.072 176.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -53.06 -58.02 8.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 122.224 1.011 . . . . 0.0 111.247 176.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.896 HD12 HD11 ' A' ' 63' ' ' LEU . 2.4 mm -72.8 -28.42 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.85 0 O-C-N 119.919 -1.738 . . . . 0.0 107.863 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.734 HG23 ' O ' ' A' ' 107' ' ' ALA . 88.6 t -57.6 -60.63 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 C-N-CA 124.058 0.943 . . . . 0.0 109.067 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 89.9 p -55.13 -30.22 59.34 Favored 'General case' 0 N--CA 1.449 -0.477 0 O-C-N 123.631 0.582 . . . . 0.0 111.258 178.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.511 ' CB ' HD23 ' A' ' 63' ' ' LEU . 5.6 m -70.3 -69.37 0.36 Allowed 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 124.172 0.92 . . . . 0.0 109.744 179.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 1.8 t -159.53 49.07 0.31 Allowed 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.483 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -142.15 24.12 2.39 Favored Glycine 0 C--O 1.213 -1.16 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.653 HG13 ' HD3' ' A' ' 120' ' ' ARG . 2.1 t -72.66 109.6 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 CA-C-N 118.509 1.155 . . . . 0.0 111.218 179.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.851 ' CZ ' HG11 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -150.28 -73.67 0.16 Allowed 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -174.301 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -121.69 -3.0 9.28 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 124.047 0.939 . . . . 0.0 109.401 177.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.707 ' HB3' HG21 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -97.91 11.99 35.56 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 123.503 0.502 . . . . 0.0 111.366 179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.653 ' HD3' HG13 ' A' ' 116' ' ' VAL . 0.0 OUTLIER -157.73 -43.44 0.06 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 123.117 0.567 . . . . 0.0 109.901 178.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.562 ' OE1' HG21 ' A' ' 124' ' ' THR . 2.9 pt20 -128.22 -154.11 0.61 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.571 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.673 HG22 ' H ' ' A' ' 123' ' ' ARG . 6.3 m -140.3 -172.87 3.52 Favored 'General case' 0 CA--C 1.499 -0.984 0 CA-C-O 117.165 -1.398 . . . . 0.0 111.216 178.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.673 ' H ' HG22 ' A' ' 122' ' ' THR . 0.5 OUTLIER -39.54 138.94 0.63 Allowed 'General case' 0 C--O 1.235 0.32 0 O-C-N 124.882 1.363 . . . . 0.0 110.759 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . 0.562 HG21 ' OE1' ' A' ' 121' ' ' GLN . 19.7 p -129.02 -37.88 1.67 Allowed 'General case' 0 C--N 1.312 -1.034 0 O-C-N 124.246 0.966 . . . . 0.0 109.11 -175.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.259 1.581 1 CA-C-O 110.92 -4.372 . . . . 0.0 110.035 -176.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -0.714 0 CA-C-O 118.378 -0.82 . . . . 0.0 108.818 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -161.97 77.32 0.51 Allowed 'General case' 0 CA--C 1.52 -0.185 0 O-C-N 123.948 0.78 . . . . 0.0 110.821 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.75 86.88 0.11 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.42 0.629 . . . . 0.0 110.81 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.2 mtp -81.43 78.87 8.15 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 121.339 -0.851 . . . . 0.0 110.513 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -94.82 177.18 5.99 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 177.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.9 p 172.7 167.69 0.12 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 122.401 1.096 . . . . 0.0 110.017 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.9 ptpt -141.16 48.65 1.67 Allowed 'General case' 0 N--CA 1.456 -0.125 0 CA-C-O 122.092 0.949 . . . . 0.0 110.985 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -171.25 59.62 0.17 Allowed Glycine 0 CA--C 1.509 -0.302 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.7 158.78 29.28 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.753 177.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.8 157.83 0.05 OUTLIER 'General case' 0 C--N 1.346 0.422 0 CA-C-O 121.944 0.878 . . . . 0.0 111.275 179.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -83.76 109.6 17.64 Favored 'General case' 0 C--N 1.32 -0.716 0 O-C-N 121.514 -0.741 . . . . 0.0 110.746 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 152.64 66.41 0.01 OUTLIER Glycine 0 C--N 1.332 0.32 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.7 t -58.79 -62.5 1.83 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.467 0.307 . . . . 0.0 110.708 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.8 p -65.12 -159.82 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 122.196 0.998 . . . . 0.0 112.037 176.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.63 -176.48 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.583 -0.698 . . . . 0.0 111.688 175.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -42.22 -53.98 3.86 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -165.6 38.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.544 1.164 . . . . 0.0 110.721 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.654 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -65.54 -47.39 76.05 Favored 'General case' 0 CA--C 1.495 -1.166 0 CA-C-O 114.745 -2.55 . . . . 0.0 107.404 179.083 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HG2' ' CE1' ' A' ' 84' ' ' TYR . 0.0 OUTLIER -38.42 -33.76 0.11 Allowed 'General case' 0 C--O 1.203 -1.357 0 O-C-N 125.131 1.52 . . . . 0.0 111.921 179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -72.41 0.2 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.384 -0.823 . . . . 0.0 112.817 173.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -57.27 -18.82 18.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 120.928 -1.108 . . . . 0.0 112.398 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 18' ' ' CYS . 70.6 t -69.78 -46.01 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.339 0 C-N-CA 126.626 1.97 . . . . 0.0 109.214 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -77.69 33.33 0.17 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.53 0.681 . . . . 0.0 112.588 178.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.9 mtm180 -138.43 -51.56 0.58 Allowed 'General case' 0 CA--C 1.504 -0.807 0 O-C-N 121.068 -1.02 . . . . 0.0 109.844 -176.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -114.38 -66.34 1.1 Allowed 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 124.608 1.193 . . . . 0.0 110.956 -175.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.639 ' HB3' HG23 ' A' ' 73' ' ' VAL . 0.5 OUTLIER -45.36 151.88 0.33 Allowed 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 116.44 -1.743 . . . . 0.0 108.233 176.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.849 HD13 HG22 ' A' ' 70' ' ' VAL . 2.7 mm? -4.32 84.86 0.0 OUTLIER 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 125.861 1.665 . . . . 0.0 111.001 -176.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.4 t -140.18 32.62 1.93 Allowed 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 125.325 2.488 . . . . 0.0 108.481 -171.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -172.36 -33.83 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.175 0 O-C-N 119.257 -2.152 . . . . 0.0 109.748 -177.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.4 m -52.77 -52.39 56.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.631 0.651 . . . . 0.0 110.527 178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.626 ' OE2' ' HB2' ' A' ' 86' ' ' ALA . 0.2 OUTLIER -72.11 -31.7 66.28 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 122.594 1.188 . . . . 0.0 111.381 176.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.0 tpp180 -62.01 -36.61 82.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.054 -1.654 . . . . 0.0 112.039 177.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 62' ' ' GLN . 74.2 t80 -54.5 -45.29 73.24 Favored 'General case' 0 N--CA 1.439 -0.995 0 C-N-CA 126.348 1.859 . . . . 0.0 110.032 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.747 HD13 ' CB ' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -74.1 -26.53 60.41 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 123.934 0.771 . . . . 0.0 111.289 177.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -41.9 82.41 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.507 0.723 . . . . 0.0 110.452 177.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.593 ' NE2' ' H ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -79.88 -166.19 0.96 Allowed 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.827 0.823 . . . . 0.0 110.405 179.469 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.593 ' H ' ' NE2' ' A' ' 36' ' ' GLN . 1.7 t -161.56 35.29 0.13 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 122.262 1.029 . . . . 0.0 110.55 177.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 60.6 p -148.05 -173.07 4.21 Favored 'General case' 0 CA--C 1.517 -0.291 0 O-C-N 120.188 -1.57 . . . . 0.0 111.291 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.8 p -83.57 -173.48 4.74 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.192 0.996 . . . . 0.0 112.412 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -85.41 109.78 18.68 Favored 'General case' 0 N--CA 1.447 -0.586 0 O-C-N 121.339 -0.851 . . . . 0.0 109.555 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.39 176.77 0.08 Allowed 'General case' 0 C--O 1.225 -0.191 0 CA-C-O 121.28 0.562 . . . . 0.0 111.748 176.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.8 m -78.39 57.61 1.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.943 0.878 . . . . 0.0 111.562 178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.7 p -93.57 99.42 11.88 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.049 -1.032 . . . . 0.0 108.754 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 92.32 118.47 2.47 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -68.56 -24.64 64.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.89 0.376 . . . . 0.0 111.282 177.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -113.82 61.51 0.66 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 123.122 1.439 . . . . 0.0 110.01 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.6 OUTLIER -87.8 22.04 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.103 0 O-C-N 120.624 -1.298 . . . . 0.0 111.255 178.206 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.4 51.64 1.2 Allowed 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 122.455 1.121 . . . . 0.0 109.686 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.97 28.25 0.61 Allowed 'General case' 0 C--O 1.234 0.278 0 O-C-N 121.19 -0.944 . . . . 0.0 112.153 178.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -126.05 161.49 51.33 Favored Pre-proline 0 N--CA 1.439 -1.02 0 O-C-N 121.536 -0.727 . . . . 0.0 111.354 -177.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -72.27 -8.91 23.59 Favored 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.763 1.642 . . . . 0.0 112.497 175.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.58 84.6 0.02 OUTLIER Glycine 0 C--N 1.348 1.227 0 O-C-N 125.07 1.481 . . . . 0.0 111.348 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 177.32 -44.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 122.153 0.978 . . . . 0.0 109.124 -178.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.34 65.07 0.71 Allowed 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.037 0.922 . . . . 0.0 109.955 -178.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -172.92 46.02 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.296 0 O-C-N 121.687 -0.633 . . . . 0.0 111.194 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -106.33 -176.8 3.18 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.734 0.778 . . . . 0.0 110.089 -177.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 tm0? -157.58 -70.68 0.1 Allowed 'General case' 0 N--CA 1.441 -0.894 0 O-C-N 121.972 -0.455 . . . . 0.0 110.231 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -178.8 -74.98 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 123.633 0.773 . . . . 0.0 110.458 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -137.03 76.67 1.6 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.862 0.839 . . . . 0.0 109.957 -177.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.457 ' OG ' HD13 ' A' ' 63' ' ' LEU . 28.6 t -176.27 96.33 0.06 Allowed 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 121.936 0.874 . . . . 0.0 109.575 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.66 -28.15 65.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.618 178.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HB3' ' CE1' ' A' ' 33' ' ' TYR . 0.9 OUTLIER -75.76 -41.1 54.1 Favored 'General case' 0 N--CA 1.439 -1.01 0 O-C-N 121.827 -0.545 . . . . 0.0 110.622 -179.002 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.091 HD11 HD12 ' A' ' 110' ' ' ILE . 3.0 mp -48.48 -28.73 3.51 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.996 0.817 . . . . 0.0 112.034 174.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -50.78 -47.13 59.77 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-O 117.885 -1.055 . . . . 0.0 111.215 172.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -52.88 -40.35 63.39 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 116.911 -1.519 . . . . 0.0 111.055 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.709 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.8 t -64.7 -51.77 60.7 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 120.347 1.43 . . . . 0.0 110.866 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 3.9 t -56.34 -39.11 72.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 120.173 1.351 . . . . 0.0 111.683 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -73.17 -30.12 63.33 Favored 'General case' 0 N--CA 1.439 -1.014 0 C-N-CA 124.789 1.236 . . . . 0.0 110.464 177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -76.54 -44.16 36.08 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.962 1.305 . . . . 0.0 109.618 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.849 HG22 HD13 ' A' ' 27' ' ' LEU . 20.1 t -69.38 -21.17 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.752 -1.217 . . . . 0.0 110.049 177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.96 -14.04 60.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 O-C-N 121.669 -0.645 . . . . 0.0 111.491 173.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.426 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 3.3 mt-30 -96.43 8.77 43.22 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 123.407 0.683 . . . . 0.0 111.195 175.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.645 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -66.4 178.99 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-O 121.164 0.506 . . . . 0.0 112.056 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.402 ' N ' HG13 ' A' ' 73' ' ' VAL . 12.9 mtt180 -82.82 -72.19 0.46 Allowed 'General case' 0 C--O 1.207 -1.17 0 CA-C-O 116.189 -1.862 . . . . 0.0 111.944 174.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 169.62 -34.58 0.0 OUTLIER 'General case' 0 C--O 1.234 0.243 0 O-C-N 127.249 2.843 . . . . 0.0 111.176 -178.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.73 -5.01 7.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.252 -0.905 . . . . 0.0 111.432 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 80.6 m -90.28 9.34 29.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-O 117.848 -1.073 . . . . 0.0 108.967 175.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.645 ' HG3' HG11 ' A' ' 73' ' ' VAL . 38.6 mt-30 -63.06 -58.47 7.19 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 120.665 1.575 . . . . 0.0 109.952 178.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.58 -50.24 32.87 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 119.966 -1.708 . . . . 0.0 111.18 -179.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -53.55 -19.96 4.43 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 124.85 1.344 . . . . 0.0 111.624 177.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.826 ' O ' HG22 ' A' ' 85' ' ' ILE . . . -77.12 -48.37 17.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-O 117.574 -1.203 . . . . 0.0 111.746 172.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.434 HD13 ' HA ' ' A' ' 82' ' ' ILE . 15.0 mm -54.35 -47.65 69.09 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 CA-C-N 119.438 1.017 . . . . 0.0 111.607 174.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.32 -6.49 29.95 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 119.971 -1.706 . . . . 0.0 112.37 176.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.51 ' CE1' ' HG2' ' A' ' 19' ' ' ARG . 31.3 t80 -110.25 18.55 19.8 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.311 2.244 . . . . 0.0 112.624 177.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.826 HG22 ' O ' ' A' ' 81' ' ' ALA . 5.4 tt -154.19 -46.22 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.504 -0.826 0 O-C-N 119.818 -1.801 . . . . 0.0 109.613 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.626 ' HB2' ' OE2' ' A' ' 31' ' ' GLU . . . -61.56 -65.76 0.64 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 125.597 1.559 . . . . 0.0 109.69 176.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.7 ' HA ' HD12 ' A' ' 90' ' ' ILE . 8.6 tt0 -73.62 -31.31 63.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.538 0.685 . . . . 0.0 111.773 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.27 -42.06 85.65 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.713 0.768 . . . . 0.0 109.172 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.591 ' O ' HD23 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -74.38 -24.1 59.08 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 116.558 -1.687 . . . . 0.0 109.943 179.02 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.7 HD12 ' HA ' ' A' ' 87' ' ' GLU . 5.2 mt -67.52 -44.24 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-N 120.081 1.309 . . . . 0.0 109.438 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -75.98 -35.82 59.49 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.768 177.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -75.57 -55.48 5.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.861 0.838 . . . . 0.0 111.524 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.452 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -61.73 179.6 3.86 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-O 122.986 1.326 . . . . 0.0 112.08 176.537 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -84.15 38.47 0.66 Allowed 'General case' 0 C--O 1.212 -0.897 0 O-C-N 120.993 -1.298 . . . . 0.0 111.169 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.896 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.4 OUTLIER -91.46 13.23 18.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 120.28 -1.512 . . . . 0.0 109.72 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -71.03 177.67 3.61 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-O 121.6 0.714 . . . . 0.0 111.589 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.17 -79.4 1.87 Allowed Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -179.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -168.22 32.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 124.396 2.046 . . . . 0.0 110.862 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -120.45 28.91 7.73 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 119.086 -2.258 . . . . 0.0 108.766 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.426 ' HB2' HG23 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -87.99 -46.05 9.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.528 0.68 . . . . 0.0 110.221 178.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -66.59 -28.77 68.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 123.565 1.65 . . . . 0.0 109.732 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.12 -27.1 67.05 Favored 'General case' 0 C--O 1.205 -1.287 0 O-C-N 119.466 -2.021 . . . . 0.0 108.589 177.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.896 HG21 ' HG ' ' A' ' 95' ' ' LEU . 3.5 t -79.98 -23.03 11.77 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 O-C-N 119.607 -1.933 . . . . 0.0 110.068 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.87 -34.63 77.04 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.196 0.522 . . . . 0.0 110.147 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -24.85 63.77 Favored 'General case' 0 C--O 1.222 -0.367 0 O-C-N 121.387 -0.82 . . . . 0.0 111.549 177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.747 ' CB ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -75.39 -59.94 2.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 123.467 0.707 . . . . 0.0 109.224 -178.266 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.583 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -57.3 -37.49 72.52 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 118.658 -0.686 . . . . 0.0 111.187 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -49.59 -31.92 15.64 Favored Glycine 0 C--N 1.341 0.825 0 O-C-N 124.34 1.025 . . . . 0.0 112.614 175.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -57.76 -56.69 18.66 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 122.652 1.215 . . . . 0.0 110.944 176.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 1.091 HD12 HD11 ' A' ' 63' ' ' LEU . 2.0 mm -73.36 -26.35 22.3 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.832 0 O-C-N 121.204 -0.935 . . . . 0.0 109.119 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.714 HG21 ' CB ' ' A' ' 119' ' ' MET . 38.1 t -59.02 -64.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.61 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 175.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 p -55.14 -30.28 59.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.716 0.689 . . . . 0.0 112.196 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.6 m -64.31 -66.36 0.55 Allowed 'General case' 0 N--CA 1.443 -0.796 0 O-C-N 123.683 0.614 . . . . 0.0 111.341 178.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.423 ' O ' HG21 ' A' ' 70' ' ' VAL . 0.1 OUTLIER -157.96 42.67 0.3 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 123.386 1.565 . . . . 0.0 111.075 178.73 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.543 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -147.61 32.38 1.34 Allowed Glycine 0 N--CA 1.441 -0.968 0 O-C-N 119.93 -1.732 . . . . 0.0 110.051 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.569 HG13 ' HB3' ' A' ' 120' ' ' ARG . 22.7 t -73.49 70.09 0.21 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 119.16 1.48 . . . . 0.0 109.715 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.528 ' HD2' HG13 ' A' ' 70' ' ' VAL . 2.6 mmp_? -98.85 -71.42 0.69 Allowed 'General case' 0 C--O 1.202 -1.438 0 CA-C-O 117.399 -1.286 . . . . 0.0 108.715 -172.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.84 -1.06 7.28 Favored 'General case' 0 N--CA 1.449 -0.509 0 O-C-N 125.545 1.778 . . . . 0.0 110.226 175.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.714 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.2 OUTLIER -96.1 6.68 48.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.88 0.847 . . . . 0.0 112.208 178.795 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.569 ' HB3' HG13 ' A' ' 116' ' ' VAL . 4.2 tpm_? -157.86 -45.22 0.06 Allowed 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 123.675 0.79 . . . . 0.0 110.227 178.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 116' ' ' VAL . 0.1 OUTLIER -133.66 -147.31 0.29 Allowed 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 118.436 -0.792 . . . . 0.0 109.319 -177.153 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.599 HG22 ' H ' ' A' ' 123' ' ' ARG . 2.1 m -143.18 -155.46 0.6 Allowed 'General case' 0 CA--C 1.504 -0.809 0 O-C-N 125.028 1.455 . . . . 0.0 109.568 -178.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.599 ' H ' HG22 ' A' ' 122' ' ' THR . 37.8 mtt180 -41.73 149.24 0.13 Allowed 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 124.772 1.229 . . . . 0.0 112.041 177.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 3.0 p -147.22 -44.0 0.17 Allowed 'General case' 0 CA--C 1.501 -0.933 0 CA-C-O 117.051 -1.452 . . . . 0.0 109.817 -173.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 31.6 t-20 . . . . . 0 C--O 1.258 1.534 0 CA-C-O 115.068 -2.396 . . . . 0.0 111.386 -175.324 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.484 ' N ' ' OD2' ' A' ' 75' ' ' ASP . . . . . . . . 0 CA--C 1.51 -0.562 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -164.58 141.94 6.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -166.09 105.71 0.68 Allowed 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 123.841 0.713 . . . . 0.0 110.02 -177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.0 tmm? -91.77 100.02 12.8 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.887 -0.508 . . . . 0.0 110.117 178.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -148.84 171.78 15.73 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.782 0.433 . . . . 0.0 110.071 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 174.82 152.52 0.11 Allowed 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 124.03 0.932 . . . . 0.0 109.809 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -168.3 142.99 3.45 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -174.55 60.93 0.12 Allowed Glycine 0 C--O 1.218 -0.847 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.08 -68.85 0.05 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.475 0.655 . . . . 0.0 110.985 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 ttt180 -73.09 173.1 9.86 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 122.063 -0.398 . . . . 0.0 110.512 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.4 100.98 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.997 0.903 . . . . 0.0 110.334 178.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -141.25 -149.41 5.23 Favored Glycine 0 N--CA 1.447 -0.615 0 N-CA-C 109.064 -1.615 . . . . 0.0 109.064 -176.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -179.7 -54.21 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.38 -147.38 0.09 Allowed 'General case' 0 CA--C 1.522 -0.108 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.4 m -62.12 -155.08 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 126.042 1.737 . . . . 0.0 111.992 176.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -72.66 -36.26 67.9 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 118.955 -2.341 . . . . 0.0 111.968 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -177.93 37.59 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 125.272 1.429 . . . . 0.0 109.298 -178.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 22' ' ' VAL . 53.3 t -81.8 -52.26 7.3 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-O 116.212 -1.851 . . . . 0.0 106.944 178.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.4 ptt-85 -24.9 -57.56 0.05 Allowed 'General case' 0 C--O 1.199 -1.554 0 CA-C-N 121.091 1.769 . . . . 0.0 115.352 175.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.589 HE21 ' N ' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -50.98 -60.75 2.76 Favored 'General case' 0 C--O 1.211 -0.97 0 O-C-N 120.376 -1.453 . . . . 0.0 113.529 170.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.589 ' N ' HE21 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.22 -24.12 67.73 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 119.369 -2.082 . . . . 0.0 111.219 174.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.528 HG23 ' SG ' ' A' ' 18' ' ' CYS . 0.5 OUTLIER -73.13 -60.02 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.21 0 N-CA-C 105.548 -2.019 . . . . 0.0 105.548 -174.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.72 47.13 0.13 Allowed 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.997 2.119 . . . . 0.0 110.684 -172.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -151.25 -52.42 0.13 Allowed 'General case' 0 CA--C 1.499 -0.991 0 O-C-N 119.67 -1.894 . . . . 0.0 110.106 -174.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.65 -32.27 6.22 Favored 'General case' 0 CA--C 1.496 -1.133 0 CA-C-O 116.333 -1.794 . . . . 0.0 112.624 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD2' ' HB1' ' A' ' 81' ' ' ALA . 0.3 OUTLIER -49.9 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 125.51 1.756 . . . . 0.0 114.627 172.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.924 HD21 ' HG3' ' A' ' 117' ' ' ARG . 0.2 OUTLIER -59.5 80.47 0.01 OUTLIER 'General case' 0 C--O 1.21 -1.018 0 O-C-N 120.653 -1.279 . . . . 0.0 112.453 171.605 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -128.94 37.69 4.04 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 126.107 1.763 . . . . 0.0 107.62 -174.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.2 t -172.85 -32.51 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.835 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.43 ' SG ' HD12 ' A' ' 27' ' ' LEU . 3.6 m -54.91 -55.33 31.71 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 118.792 0.723 . . . . 0.0 110.65 179.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.614 ' OE1' HD11 ' A' ' 34' ' ' LEU . 1.4 mm-40 -73.15 -33.36 65.44 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 124.212 1.958 . . . . 0.0 110.558 175.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.9 tpp85 -58.45 -31.03 67.4 Favored 'General case' 0 C--O 1.213 -0.822 0 O-C-N 118.077 -2.889 . . . . 0.0 112.324 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.512 ' CD2' HD11 ' A' ' 110' ' ' ILE . 44.7 t80 -58.94 -55.94 28.63 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 126.795 2.038 . . . . 0.0 110.175 -178.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' OE1' ' A' ' 31' ' ' GLU . 4.5 pp -73.86 -15.18 61.16 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 124.298 0.999 . . . . 0.0 111.874 176.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -80.83 -33.14 34.86 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.197 0.599 . . . . 0.0 111.554 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -164.52 0.78 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 124.888 1.275 . . . . 0.0 109.506 -179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.17 -42.79 0.18 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.862 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 99.7 p -144.01 116.01 8.35 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 121.618 -0.676 . . . . 0.0 109.785 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.9 t -150.92 127.31 10.67 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -168.1 62.07 0.07 Allowed 'General case' 0 C--O 1.234 0.252 0 O-C-N 123.715 0.635 . . . . 0.0 109.838 178.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -43.04 141.57 1.13 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 123.349 1.547 . . . . 0.0 111.599 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 89.3 p -86.73 98.9 11.4 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 120.396 -1.44 . . . . 0.0 109.475 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 m -139.79 138.02 35.5 Favored 'General case' 0 C--N 1.324 -0.517 0 O-C-N 120.932 -1.105 . . . . 0.0 108.875 -178.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.71 -0.78 51.32 Favored Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.818 -0.435 . . . . 0.0 112.868 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -146.55 64.32 1.2 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.211 1.404 . . . . 0.0 109.795 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -97.55 -155.25 0.48 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 123.33 1.538 . . . . 0.0 110.823 176.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.564 HG21 ' HA ' ' A' ' 65' ' ' GLN . 1.2 p -85.14 22.33 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 O-C-N 120.999 -1.063 . . . . 0.0 112.399 174.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.3 mt -90.83 46.15 1.31 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.124 -0.985 . . . . 0.0 109.884 178.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -130.58 172.93 11.39 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 121.458 -0.776 . . . . 0.0 111.047 178.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -165.83 78.14 1.21 Allowed Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -73.12 -16.28 25.39 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 120.958 1.105 . . . . 0.0 112.425 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 139.8 102.1 0.51 Allowed Glycine 0 C--O 1.222 -0.625 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 173.15 114.21 0.02 OUTLIER 'General case' 0 CA--C 1.51 -0.571 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -40.97 95.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 O-C-N 124.817 1.323 . . . . 0.0 111.926 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -116.59 -167.26 1.26 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -176.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -38.51 152.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 122.578 1.18 . . . . 0.0 113.872 172.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.2 -32.86 14.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 119.479 -0.889 . . . . 0.0 111.047 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -165.92 -84.1 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.424 0.69 . . . . 0.0 110.577 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -88.32 86.1 7.0 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 121.375 -0.828 . . . . 0.0 110.806 -177.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.65 52.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.938 0.875 . . . . 0.0 112.134 -174.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -62.17 -28.47 69.68 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 122.867 1.318 . . . . 0.0 111.602 -177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' CB ' ' CD1' ' A' ' 33' ' ' TYR . 2.9 mm-40 -76.01 -46.08 31.25 Favored 'General case' 0 N--CA 1.444 -0.76 0 O-C-N 121.382 -0.824 . . . . 0.0 112.126 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 113' ' ' SER . 8.3 tt -48.0 -34.79 9.88 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 118.438 0.563 . . . . 0.0 111.44 175.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.553 ' HG2' HG22 ' A' ' 47' ' ' VAL . 4.6 tt0 -65.84 -51.04 62.28 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 172.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.564 ' HA ' HG21 ' A' ' 47' ' ' VAL . 2.3 tm0? -53.04 -32.42 46.73 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-O 117.172 -1.394 . . . . 0.0 111.215 176.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.787 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.6 t -66.71 -56.38 10.85 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 117.469 -1.253 . . . . 0.0 109.052 173.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.3 t -50.23 -53.9 24.94 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 120.87 1.668 . . . . 0.0 112.962 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -57.63 -34.9 69.81 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-O 121.292 0.568 . . . . 0.0 111.957 174.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -63.66 -50.11 70.55 Favored 'General case' 0 C--O 1.224 -0.283 0 O-C-N 121.534 -0.729 . . . . 0.0 110.028 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 66' ' ' CYS . 1.5 t -68.43 -18.99 23.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 O-C-N 120.486 -1.384 . . . . 0.0 109.801 -179.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.35 47.47 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 121.167 -0.958 . . . . 0.0 111.34 174.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -92.52 0.7 57.46 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.025 0.93 . . . . 0.0 111.672 177.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.689 HG11 ' HG3' ' A' ' 78' ' ' GLN . 2.2 p -66.65 174.01 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 O-C-N 124.382 1.051 . . . . 0.0 110.771 176.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.524 ' H ' HG22 ' A' ' 73' ' ' VAL . 0.0 OUTLIER -60.72 -86.3 0.01 OUTLIER 'General case' 0 C--O 1.204 -1.308 0 CA-C-O 114.983 -2.437 . . . . 0.0 109.688 177.118 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.484 ' OD2' ' N ' ' A' ' 1' ' ' ALA . 39.3 m-20 -175.93 -84.55 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 O-C-N 126.844 2.59 . . . . 0.0 109.255 -175.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.69 -5.43 47.91 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.611 1.164 . . . . 0.0 113.067 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 81' ' ' ALA . 1.6 m -85.94 -4.71 59.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 CA-C-O 116.262 -1.828 . . . . 0.0 108.108 177.343 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.689 ' HG3' HG11 ' A' ' 73' ' ' VAL . 15.0 mt-30 -53.74 -43.96 69.55 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 121.242 1.837 . . . . 0.0 110.32 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -63.61 1.03 Allowed 'General case' 0 CA--C 1.505 -0.788 0 O-C-N 120.12 -1.612 . . . . 0.0 111.494 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -52.07 -21.41 3.17 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 125.88 1.988 . . . . 0.0 110.908 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.556 ' HB1' ' OD2' ' A' ' 26' ' ' ASP . . . -67.25 -47.04 71.92 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 124.025 1.869 . . . . 0.0 111.598 175.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.526 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -69.59 -28.94 39.59 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 O-C-N 119.846 -1.783 . . . . 0.0 109.594 177.171 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 mmmt -67.9 -12.03 59.86 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 118.654 -0.689 . . . . 0.0 111.606 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -91.72 -62.12 1.49 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.988 1.315 . . . . 0.0 109.649 176.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 85' ' ' ILE . 6.5 tp -60.94 -48.68 87.93 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.729 0 CA-C-O 118.38 -0.819 . . . . 0.0 110.92 -176.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.401 ' CB ' ' CE ' ' A' ' 119' ' ' MET . . . -80.69 53.5 1.91 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 125.479 1.512 . . . . 0.0 109.008 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.675 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.2 tm-20 -172.98 -55.07 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.266 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.56 -49.72 76.42 Favored 'General case' 0 CA--C 1.507 -0.692 0 O-C-N 120.976 -1.077 . . . . 0.0 108.234 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.57 ' O ' HD23 ' A' ' 95' ' ' LEU . 2.6 pt20 -60.41 -31.47 70.42 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 116.54 -1.695 . . . . 0.0 110.842 177.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.675 HD12 ' HA ' ' A' ' 87' ' ' GLU . 67.8 mt -65.96 -39.03 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-N 119.629 1.104 . . . . 0.0 110.094 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.7 -35.32 39.22 Favored 'General case' 0 N--CA 1.445 -0.714 0 O-C-N 121.499 -0.751 . . . . 0.0 111.026 177.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -58.51 3.23 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.416 1.086 . . . . 0.0 111.355 -177.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.455 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -58.81 177.67 1.97 Allowed Glycine 0 CA--C 1.531 1.058 0 CA-C-O 123.55 1.639 . . . . 0.0 112.268 173.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -81.42 41.0 0.59 Allowed 'General case' 0 C--O 1.206 -1.189 0 O-C-N 120.916 -1.344 . . . . 0.0 111.136 178.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.803 ' HG ' HG21 ' A' ' 103' ' ' VAL . 0.5 OUTLIER -93.3 18.31 9.81 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 119.492 -2.005 . . . . 0.0 109.413 -179.462 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -79.42 -176.56 5.31 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 124.074 0.95 . . . . 0.0 111.162 176.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 70.29 -78.64 0.43 Allowed Glycine 0 C--O 1.224 -0.512 0 CA-C-O 118.562 -1.132 . . . . 0.0 110.31 -178.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -165.69 65.73 0.12 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 124.064 1.887 . . . . 0.0 111.968 177.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -158.44 27.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 120.046 -1.659 . . . . 0.0 109.704 -175.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.575 ' OG ' HG21 ' A' ' 90' ' ' ILE . 3.4 t -92.89 -47.26 7.11 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 123.923 0.889 . . . . 0.0 111.228 177.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -61.46 -26.77 68.11 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 123.277 1.513 . . . . 0.0 110.587 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.44 ' HD2' ' CZ ' ' A' ' 106' ' ' ARG . 0.2 OUTLIER -67.14 -25.92 66.41 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 119.882 -1.762 . . . . 0.0 112.381 175.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.803 HG21 ' HG ' ' A' ' 95' ' ' LEU . 5.1 t -80.91 -29.92 11.63 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.893 0 C-N-CA 124.918 1.287 . . . . 0.0 108.31 177.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.64 -48.66 71.42 Favored 'General case' 0 C--N 1.327 -0.389 0 O-C-N 120.077 -1.639 . . . . 0.0 111.094 178.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -69.19 -28.88 66.79 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.838 177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.581 ' CG ' HD13 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -55.65 -53.7 53.23 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 123.811 0.845 . . . . 0.0 109.577 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.646 ' O ' HG23 ' A' ' 111' ' ' VAL . . . -52.26 -34.5 46.53 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 116.733 -1.603 . . . . 0.0 109.295 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.404 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -33.36 -39.55 0.1 OUTLIER Glycine 0 C--N 1.348 1.21 0 C-N-CA 127.25 2.357 . . . . 0.0 113.637 173.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -53.55 -67.34 0.26 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 122.056 0.931 . . . . 0.0 111.939 171.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.777 ' CD1' HD12 ' A' ' 63' ' ' LEU . 6.5 mm -66.87 -24.89 33.28 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 O-C-N 121.469 -0.769 . . . . 0.0 111.099 179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.671 HG11 ' HB3' ' A' ' 119' ' ' MET . 63.5 t -59.09 -61.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.88 0 C-N-CA 123.853 0.861 . . . . 0.0 109.592 176.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -33.28 64.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 118.54 -0.743 . . . . 0.0 111.366 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.868 ' HB3' HD21 ' A' ' 63' ' ' LEU . 11.1 m -65.79 -66.8 0.5 Allowed 'General case' 0 C--O 1.221 -0.437 0 O-C-N 123.797 0.686 . . . . 0.0 112.19 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.591 ' O ' HG21 ' A' ' 70' ' ' VAL . 4.3 t -160.26 52.88 0.32 Allowed 'General case' 0 C--O 1.216 -0.67 0 CA-C-O 123.356 1.55 . . . . 0.0 109.931 177.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' C ' ' HA ' ' A' ' 111' ' ' VAL . . . -149.88 18.35 1.09 Allowed Glycine 0 C--O 1.216 -0.993 0 O-C-N 120.132 -1.605 . . . . 0.0 109.965 -178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.771 HG23 ' HB3' ' A' ' 120' ' ' ARG . 3.5 p -72.99 64.53 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 C-N-CA 126.057 1.743 . . . . 0.0 109.517 178.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.924 ' HG3' HD21 ' A' ' 27' ' ' LEU . 2.4 mmp_? -99.26 -74.75 0.58 Allowed 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.166 -175.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.74 -1.81 10.5 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 123.585 0.754 . . . . 0.0 110.369 174.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.671 ' HB3' HG11 ' A' ' 111' ' ' VAL . 0.0 OUTLIER -84.98 2.76 41.59 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 177.718 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.771 ' HB3' HG23 ' A' ' 116' ' ' VAL . 6.0 ttm180 -157.47 -91.53 0.03 OUTLIER 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 124.276 1.03 . . . . 0.0 110.018 178.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -108.93 117.55 34.5 Favored 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 124.845 1.258 . . . . 0.0 107.943 -174.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 20.0 p -71.64 139.84 49.45 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.242 -178.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.83 174.64 0.66 Allowed 'General case' 0 CA--C 1.516 -0.331 0 C-N-CA 123.508 0.723 . . . . 0.0 110.18 -179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 16.3 p -149.68 113.4 5.05 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -173.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 1.7 m120 . . . . . 0 C--O 1.253 1.279 0 O-C-N 121.629 -0.669 . . . . 0.0 109.446 177.25 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.351 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.39 170.44 10.54 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 123.757 0.661 . . . . 0.0 111.175 178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -57.73 133.89 55.76 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.813 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 ttt -152.86 147.88 26.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.816 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 173.58 2.28 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 124.011 0.819 . . . . 0.0 110.363 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.6 t -49.36 174.42 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.678 1.227 . . . . 0.0 110.701 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.47 109.07 0.13 Allowed 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 120.848 -1.157 . . . . 0.0 110.302 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.76 55.09 0.23 Allowed Glycine 0 C--O 1.22 -0.767 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.36 -40.48 0.06 Allowed 'General case' 0 C--O 1.226 -0.148 0 CA-C-O 121.678 0.751 . . . . 0.0 110.82 178.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -161.62 -43.98 0.04 OUTLIER 'General case' 0 C--O 1.213 -0.851 0 O-C-N 121.357 -0.839 . . . . 0.0 110.475 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.38 147.1 46.03 Favored 'General case' 0 N--CA 1.447 -0.595 0 O-C-N 123.211 0.319 . . . . 0.0 110.41 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.75 -161.75 20.11 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 111.176 -0.77 . . . . 0.0 111.176 -178.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.4 m -81.37 48.94 1.21 Allowed 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.503 0.668 . . . . 0.0 110.748 179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.8 p -166.59 114.15 0.86 Allowed 'General case' 0 C--O 1.215 -0.711 0 CA-C-O 122.012 0.91 . . . . 0.0 110.17 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -155.17 -40.69 0.09 Allowed 'General case' 0 CA--C 1.502 -0.877 0 CA-C-O 116.722 -1.608 . . . . 0.0 110.422 179.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -44.33 -84.79 0.0 OUTLIER 'General case' 0 C--N 1.345 0.388 0 O-C-N 125.803 1.939 . . . . 0.0 110.33 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -157.09 20.4 0.31 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.435 0.636 . . . . 0.0 109.939 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.537 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -80.14 -48.34 13.34 Favored 'General case' 0 CA--C 1.475 -1.938 0 CA-C-O 113.859 -2.972 . . . . 0.0 107.557 -179.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.57 -32.4 0.56 Allowed 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 122.489 2.404 . . . . 0.0 111.792 178.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -62.98 1.27 Allowed 'General case' 0 N--CA 1.428 -1.525 0 O-C-N 123.968 0.793 . . . . 0.0 111.701 173.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.23 -30.7 64.82 Favored 'General case' 0 C--O 1.208 -1.113 0 O-C-N 119.923 -1.735 . . . . 0.0 114.143 176.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.585 HG11 ' OE2' ' A' ' 80' ' ' GLU . 86.6 t -61.48 -44.44 98.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.514 0 C-N-CA 127.644 2.378 . . . . 0.0 107.721 178.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -79.93 40.73 0.48 Allowed 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 121.929 -0.482 . . . . 0.0 112.049 179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -152.01 -43.82 0.11 Allowed 'General case' 0 CA--C 1.508 -0.643 0 C-N-CA 123.251 0.62 . . . . 0.0 109.575 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HB2' ' CB ' ' A' ' 72' ' ' GLN . 0.0 OUTLIER -122.52 -64.34 1.2 Allowed 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 124.617 1.198 . . . . 0.0 108.779 -174.323 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.486 ' HB2' HG13 ' A' ' 22' ' ' VAL . 1.0 OUTLIER -43.85 150.06 0.28 Allowed 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 113.637 -3.078 . . . . 0.0 109.668 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD21 ' HG2' ' A' ' 117' ' ' ARG . 1.5 mm? -5.12 84.36 0.0 OUTLIER 'General case' 0 C--N 1.346 0.414 0 O-C-N 126.931 2.645 . . . . 0.0 112.776 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.5 p -143.0 39.11 1.46 Allowed 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 106.498 -1.667 . . . . 0.0 106.498 -168.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -177.01 -28.89 0.01 OUTLIER 'General case' 0 C--O 1.188 -2.182 0 CA-C-O 116.552 -1.69 . . . . 0.0 108.416 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.527 ' SG ' HD12 ' A' ' 27' ' ' LEU . 39.2 m -59.86 -60.11 4.36 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 122.02 2.191 . . . . 0.0 109.11 179.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.647 ' HG2' ' HB2' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -72.08 -39.98 68.6 Favored 'General case' 0 C--O 1.214 -0.815 0 CA-C-O 124.435 2.064 . . . . 0.0 109.355 179.328 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.475 ' H ' HD11 ' A' ' 85' ' ' ILE . 25.3 ttm180 -58.84 -43.21 90.66 Favored 'General case' 0 C--O 1.198 -1.651 0 O-C-N 117.591 -3.193 . . . . 0.0 110.089 179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -47.95 -46.3 32.08 Favored 'General case' 0 C--N 1.306 -1.295 0 C-N-CA 126.936 2.094 . . . . 0.0 110.158 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 106' ' ' ARG . 0.4 OUTLIER -75.08 -27.08 59.79 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 125.065 1.478 . . . . 0.0 109.309 179.454 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.495 ' HB2' HE22 ' A' ' 89' ' ' GLN . 3.3 ttm180 -68.93 -46.37 68.41 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.206 0.602 . . . . 0.0 109.646 178.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -79.08 -165.19 0.71 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 123.265 0.626 . . . . 0.0 110.648 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.81 -45.22 11.79 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.13 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 91.3 p -172.21 120.78 0.43 Allowed 'General case' 0 C--O 1.239 0.502 0 CA-C-O 118.865 -0.588 . . . . 0.0 109.669 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -32.63 125.71 0.32 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 122.553 1.168 . . . . 0.0 112.247 174.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.56 -61.4 0.02 OUTLIER 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.125 -179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -47.28 116.58 1.45 Allowed 'General case' 0 C--N 1.345 0.386 0 O-C-N 123.655 0.597 . . . . 0.0 109.711 -178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 59.5 p -170.34 -151.39 0.08 Allowed 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 124.479 1.112 . . . . 0.0 110.038 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.8 m -82.33 143.14 31.47 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.696 0.799 . . . . 0.0 110.623 179.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -72.87 -115.41 0.06 OUTLIER Glycine 0 C--N 1.333 0.388 0 CA-C-O 122.019 0.788 . . . . 0.0 111.412 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -66.25 -10.15 39.36 Favored 'General case' 0 C--O 1.213 -0.839 0 O-C-N 122.147 -0.62 . . . . 0.0 110.169 178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -101.06 54.13 0.84 Allowed 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 123.316 1.531 . . . . 0.0 109.973 178.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.8 OUTLIER -139.63 29.68 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 O-C-N 118.583 -2.573 . . . . 0.0 108.868 -179.451 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.1 35.97 4.59 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 120.481 -1.387 . . . . 0.0 109.328 -178.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.06 29.37 6.79 Favored 'General case' 0 CA--C 1.51 -0.575 0 O-C-N 121.829 -0.544 . . . . 0.0 111.721 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.466 ' CB ' ' HD3' ' A' ' 51' ' ' PRO . 0.1 OUTLIER 168.28 -53.73 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 123.644 0.778 . . . . 0.0 111.021 -175.643 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.466 ' HD3' ' CB ' ' A' ' 50' ' ' MET . 17.7 Cg_endo -75.34 86.62 1.43 Allowed 'Trans proline' 0 N--CA 1.448 -1.179 0 C-N-CA 122.515 2.144 . . . . 0.0 111.264 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -156.72 -90.97 0.08 OUTLIER Glycine 0 C--O 1.218 -0.891 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -76.37 -69.5 0.5 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -178.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -58.18 -179.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.097 0.873 . . . . 0.0 110.04 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 59.14 165.11 0.05 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 122.794 1.283 . . . . 0.0 110.343 -178.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -43.11 127.36 4.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 111.238 178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -156.47 86.36 1.0 Allowed 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.494 1.121 . . . . 0.0 109.746 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -166.76 -57.69 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -158.37 50.4 0.4 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 123.112 1.434 . . . . 0.0 110.156 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 69.2 p -168.55 53.66 0.05 Allowed 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 120.323 -1.486 . . . . 0.0 108.942 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -63.56 -18.47 63.9 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.587 0.708 . . . . 0.0 110.6 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -71.01 -51.59 24.52 Favored 'General case' 0 N--CA 1.442 -0.872 0 O-C-N 121.513 -0.742 . . . . 0.0 110.11 179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.954 HD11 HD12 ' A' ' 110' ' ' ILE . 2.0 mp -67.84 -27.64 66.87 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -51.59 -31.35 24.51 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.938 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.88 -34.22 64.37 Favored 'General case' 0 C--O 1.195 -1.801 0 CA-C-O 117.659 -1.162 . . . . 0.0 110.087 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.875 ' O ' HG23 ' A' ' 70' ' ' VAL . 1.9 t -67.78 -51.76 45.06 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 120.62 1.554 . . . . 0.0 109.555 175.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 11.9 t -58.97 -52.9 63.79 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 120.021 1.282 . . . . 0.0 109.807 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -59.1 -25.5 63.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 123.168 0.292 . . . . 0.0 110.567 176.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -76.32 -41.5 48.26 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.841 0.829 . . . . 0.0 110.852 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.875 HG23 ' O ' ' A' ' 66' ' ' CYS . 2.8 t -76.28 -19.36 15.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 O-C-N 120.868 -1.145 . . . . 0.0 107.968 -179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -14.71 60.2 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 120.93 -1.106 . . . . 0.0 109.877 176.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.448 ' CB ' ' HB2' ' A' ' 25' ' ' LYS . 10.5 mm100 -99.22 12.73 35.34 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 124.67 1.231 . . . . 0.0 110.848 177.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.495 HG11 ' HG3' ' A' ' 78' ' ' GLN . 0.3 OUTLIER -68.65 176.14 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 O-C-N 123.251 0.345 . . . . 0.0 110.554 178.562 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 -65.79 0.97 Allowed 'General case' 0 C--O 1.204 -1.333 0 CA-C-O 116.107 -1.902 . . . . 0.0 110.336 177.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 157.41 -24.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 O-C-N 126.398 2.311 . . . . 0.0 110.363 -177.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -136.06 4.03 2.95 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.31 0.644 . . . . 0.0 109.726 -179.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 83.2 m -100.25 0.57 40.56 Favored 'General case' 0 C--O 1.202 -1.424 0 CA-C-O 117.113 -1.422 . . . . 0.0 108.246 177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.8 mp0 -47.18 -83.92 0.01 OUTLIER 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 124.791 1.237 . . . . 0.0 110.834 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.96 -50.26 58.44 Favored 'General case' 0 N--CA 1.439 -1.007 0 O-C-N 119.434 -2.042 . . . . 0.0 110.682 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' OE2' HG11 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -44.11 -25.84 0.25 Allowed 'General case' 0 CA--C 1.542 0.661 0 O-C-N 126.311 2.257 . . . . 0.0 111.955 175.81 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.72 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -73.61 -53.28 10.84 Favored 'General case' 0 N--CA 1.425 -1.68 0 C-N-CA 124.83 1.252 . . . . 0.0 109.596 177.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.751 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 19.5 mm -55.32 -38.53 48.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 O-C-N 119.3 -2.125 . . . . 0.0 110.684 175.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.1 mptt -70.74 -2.19 13.84 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 120.854 -1.154 . . . . 0.0 109.686 179.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.456 ' CG ' ' N ' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -112.62 -62.52 1.57 Allowed 'General case' 0 C--O 1.179 -2.643 0 CA-C-O 116.558 -1.687 . . . . 0.0 108.717 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.475 HD11 ' H ' ' A' ' 32' ' ' ARG . 0.7 OUTLIER -67.16 -50.19 65.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 122.357 2.344 . . . . 0.0 107.553 -176.545 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.751 ' HB3' ' O ' ' A' ' 82' ' ' ILE . . . -62.75 -58.99 5.54 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -58.6 -32.54 69.09 Favored 'General case' 0 C--O 1.199 -1.594 0 CA-C-O 117.645 -1.169 . . . . 0.0 110.559 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -52.8 -74.76 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.091 0 C-N-CA 126.297 1.839 . . . . 0.0 107.307 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.567 ' O ' HD23 ' A' ' 95' ' ' LEU . 5.6 pt20 -56.77 -46.79 81.23 Favored 'General case' 0 C--O 1.199 -1.603 0 CA-C-O 116.166 -1.873 . . . . 0.0 108.499 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.735 HD12 ' C ' ' A' ' 86' ' ' ALA . 49.2 mt -52.12 -31.61 14.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-N 120.815 1.643 . . . . 0.0 109.185 -178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.594 ' HA ' ' CE1' ' A' ' 96' ' ' HIS . 1.4 mm100 -93.28 -26.59 17.26 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.789 -1.194 . . . . 0.0 111.397 177.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -75.47 -61.65 1.84 Allowed 'General case' 0 N--CA 1.428 -1.552 0 C-N-CA 124.947 1.299 . . . . 0.0 108.606 -179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.489 ' C ' HD22 ' A' ' 95' ' ' LEU . . . -72.67 -174.51 25.57 Favored Glycine 0 N--CA 1.435 -1.432 0 CA-C-O 123.134 1.408 . . . . 0.0 111.618 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -88.06 47.3 1.48 Allowed 'General case' 0 C--O 1.195 -1.794 0 O-C-N 121.531 -0.982 . . . . 0.0 109.495 179.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.653 HD23 ' HA ' ' A' ' 90' ' ' ILE . 0.8 OUTLIER -82.34 4.72 22.76 Favored 'General case' 0 C--O 1.196 -1.756 0 O-C-N 119.292 -2.13 . . . . 0.0 108.075 179.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . 0.594 ' CE1' ' HA ' ' A' ' 91' ' ' GLN . 7.2 m-70 -84.94 -157.25 0.29 Allowed 'General case' 0 C--N 1.318 -0.784 0 O-C-N 119.149 -2.219 . . . . 0.0 109.605 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 65.16 -75.61 0.08 OUTLIER Glycine 0 C--O 1.223 -0.586 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -167.13 35.76 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 123.442 1.592 . . . . 0.0 110.506 177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -131.62 24.77 4.74 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 119.478 -2.014 . . . . 0.0 108.841 -177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -34.4 12.57 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.07 -30.01 64.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 122.97 1.366 . . . . 0.0 108.992 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -66.42 -25.14 66.61 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 119.888 -1.758 . . . . 0.0 109.279 177.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.486 HG11 HG12 ' A' ' 90' ' ' ILE . 3.3 t -81.62 -22.07 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 CA-C-N 118.911 0.778 . . . . 0.0 109.439 -179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.51 -41.89 75.45 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -63.97 -36.21 83.23 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.418 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.716 ' HB3' HD22 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -61.43 -57.69 11.19 Favored 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -179.22 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.647 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . . . -64.32 -45.68 86.85 Favored 'General case' 0 CA--C 1.499 -0.997 0 CA-C-O 117.624 -1.179 . . . . 0.0 108.813 -176.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.42 ' HA2' ' HB ' ' A' ' 111' ' ' VAL . . . -39.87 -32.9 0.37 Allowed Glycine 0 C--N 1.343 0.965 0 O-C-N 125.244 1.59 . . . . 0.0 111.969 176.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -54.21 -55.01 32.2 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 122.483 1.135 . . . . 0.0 111.917 174.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.954 HD12 HD11 ' A' ' 63' ' ' LEU . 1.8 mm -72.91 -30.48 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 O-C-N 120.259 -1.525 . . . . 0.0 107.72 -178.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.848 HG21 ' CB ' ' A' ' 119' ' ' MET . 37.5 t -56.75 -54.73 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.944 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.413 177.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 28.5 t -55.36 -21.12 13.92 Favored 'General case' 0 C--N 1.331 -0.205 0 O-C-N 123.863 0.727 . . . . 0.0 110.538 178.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.434 ' OG ' HD23 ' A' ' 63' ' ' LEU . 3.8 m -77.48 -66.65 0.81 Allowed 'General case' 0 N--CA 1.443 -0.798 0 O-C-N 122.08 -0.387 . . . . 0.0 109.967 178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.558 ' O ' HG21 ' A' ' 70' ' ' VAL . 9.1 t -159.56 45.66 0.26 Allowed 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.592 ' O ' HG13 ' A' ' 111' ' ' VAL . . . -142.93 32.35 1.92 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-O 117.455 -1.747 . . . . 0.0 109.66 -179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.745 HG13 ' CG ' ' A' ' 120' ' ' ARG . 42.4 t -71.89 59.98 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 123.166 1.46 . . . . 0.0 110.105 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.81 ' HG2' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -95.02 -92.99 0.19 Allowed 'General case' 0 C--O 1.188 -2.146 0 O-C-N 119.258 -2.151 . . . . 0.0 108.588 -176.267 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -103.58 -2.89 25.98 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.738 0.815 . . . . 0.0 109.563 177.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.848 ' CB ' HG21 ' A' ' 111' ' ' VAL . 0.1 OUTLIER -95.62 10.83 35.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 120.981 0.419 . . . . 0.0 111.829 179.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.745 ' CG ' HG13 ' A' ' 116' ' ' VAL . 0.7 OUTLIER -159.45 -43.75 0.05 Allowed 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 123.082 0.553 . . . . 0.0 110.037 179.012 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.419 ' NE2' ' HA ' ' A' ' 121' ' ' GLN . 0.1 OUTLIER -130.91 -156.17 0.74 Allowed 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.842 -178.773 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . 0.633 HG22 ' H ' ' A' ' 123' ' ' ARG . 4.3 m -94.46 -159.81 0.73 Allowed 'General case' 0 C--O 1.21 -0.99 0 C-N-CA 124.108 0.963 . . . . 0.0 110.172 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.633 ' H ' HG22 ' A' ' 122' ' ' THR . 0.0 OUTLIER -43.37 -82.77 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.418 0 O-C-N 120.945 -1.097 . . . . 0.0 111.758 -178.862 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.0 p -47.24 162.16 0.06 Allowed 'General case' 0 N--CA 1.448 -0.569 0 O-C-N 126.195 2.185 . . . . 0.0 110.664 178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 13.7 t30 . . . . . 0 CA--C 1.57 1.728 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.905 178.869 . . . . . . . . 0 0 . 1 stop_ save_